Reference/ChEBI CHEBI 16136
type: UnificationXref
id: CHEBI:16136
db: ChEBI

Reference/PubChem-compound 6022
type: UnificationXref
id: 6022
db: PubChem-compound

Hydrogen sulfide
type: SmallMolecule
entity reference: Hydrogen sulfide

sulfate adenylyltransferase
type: Complex
component stoichiometry: Protein/28277/Stoichiometry/4.0
component: Unknown

Reference/ChemSpider 937
type: UnificationXref
id: 937
db: ChemSpider

cysteine synthase B
type: Complex
component stoichiometry: Protein/28277/Stoichiometry/2.0
component: Unknown

Reference/BioCyc CYS
type: UnificationXref
id: CYS
db: BioCyc

Reference/PubChem-compound 123991
type: UnificationXref
id: 123991
db: PubChem-compound

3'-phospho-adenylylsulfate reductase
type: Complex
component stoichiometry: Protein/28277/Stoichiometry/2.0
component: Unknown

Reference/BioCyc S2O3
type: UnificationXref
id: S2O3
db: BioCyc

Compound/PW C001065/Stoichiometry/1.0
type: Stoichiometry
physical entity: Oxygen
stoichiometric coefficient: 1.0

Reference/PubChem-compound 18779926
type: UnificationXref
id: 18779926
db: PubChem-compound

Reference/ChemSpider 50
type: UnificationXref
id: 50
db: ChemSpider

Compound/PW C040034/Stoichiometry/1.0
type: Stoichiometry
physical entity: Hydrogen Ion
stoichiometric coefficient: 1.0

Reference/ChEBI CHEBI 17359
type: UnificationXref
id: CHEBI:17359
db: ChEBI

2-Aminoacrylic acid
type: SmallMolecule
entity reference: 2-Aminoacrylic acid

Reference/KEGG Compound C00320
type: UnificationXref
id: C00320
db: KEGG Compound

Reference/BioCyc ATP
type: UnificationXref
id: ATP
db: BioCyc

βine aldehyde
type: SmallMolecule
entity reference: βine aldehyde

Ammonium
type: SmallMoleculeReference
xref: Reference/HMDB HMDB0041827
xref: Reference/CAS 14798-03-9
xref: Reference/PubChem-compound 16741146
xref: Reference/KEGG Compound C01342
xref: Reference/ChEBI CHEBI 28938
xref: Reference/ChemSpider 218
chemical formula: H4N
molecular weight: 18.034374
structure: ChemicalStructure/PW C022608

Compound/PW C001420/Stoichiometry/3.0
type: Stoichiometry
physical entity: Water
stoichiometric coefficient: 3.0

Reference/CAS 14808-79-8
type: UnificationXref
id: 14808-79-8
db: CAS

Reference/ChemSpider 559142
type: UnificationXref
id: 559142
db: ChemSpider

adenylylsulfate kinase
type: Complex
component stoichiometry: Protein/28277/Stoichiometry/2.0
component: Unknown

Reference/HMDB HMDB0003011
type: UnificationXref
id: HMDB0003011
db: HMDB

ReactionCoupledTransportCatalysis20347
type: Catalysis
controller: Unknown
controlled: ReactionCoupledTransport20285
control type: ACTIVATION

Compound/PW C001034/Stoichiometry/1.0
type: Stoichiometry
physical entity: Adenosine diphosphate
stoichiometric coefficient: 1.0

Reference/ChemSpider 5742
type: UnificationXref
id: 5742
db: ChemSpider

Protein/28277/Stoichiometry/8.0
type: Stoichiometry
physical entity: Unknown
stoichiometric coefficient: 8.0

Reference/KEGG Compound C00576
type: UnificationXref
id: C00576
db: KEGG Compound

Reference/ChEBI CHEBI 17561
type: UnificationXref
id: CHEBI:17561
db: ChEBI

Reference/ChEBI CHEBI 16474
type: UnificationXref
id: CHEBI:16474
db: ChEBI

Reference/ChemSpider 952
type: UnificationXref
id: 952
db: ChemSpider

Compound/PW C001755/Stoichiometry/1.0
type: Stoichiometry
physical entity: O-Acetylserine
stoichiometric coefficient: 1.0

3.1.3.7
type: BiochemicalReaction
participant stoichiometry: Compound/PW C001420/Stoichiometry/1.0
participant stoichiometry: Compound/PW C000793/Stoichiometry/1.0
participant stoichiometry: Compound/PW C000886/Stoichiometry/1.0
participant stoichiometry: Compound/PW C001104/Stoichiometry/1.0
right: Adenosine phosphosulfate
right: Phosphate
spontaneous: false
EC number: 3.1.3.7
left: Water
left: Phosphoadenosine phosphosulfate
name: Phosphoadenosine phosphosulfate + Water ↔ Adenosine phosphosulfate + Phosphate
conversion direction: REVERSIBLE

Reaction1033291
type: BiochemicalReaction
participant stoichiometry: Compound/PW C000448/Stoichiometry/1.0
participant stoichiometry: Compound/PW C001827/Stoichiometry/1.0
participant stoichiometry: Compound/PW C040034/Stoichiometry/1.0
participant stoichiometry: Compound/PW C001938/Stoichiometry/1.0
right: Hydrogen sulfide
right: Hydrogen Ion
right: 2-Aminoacrylic acid
spontaneous: false
left: L-Cysteine
name: L-Cysteine → 2-Aminoacrylic acid + Hydrogen Ion + Hydrogen sulfide
conversion direction: LEFT_TO_RIGHT

Reference/BioCyc BETAINE ALDEHYDE
type: UnificationXref
id: BETAINE_ALDEHYDE
db: BioCyc

1.8.4.8
type: BiochemicalReaction
participant stoichiometry: Compound/PW C000162/Stoichiometry/1.0
participant stoichiometry: Compound/PW C000043/Stoichiometry/1.0
participant stoichiometry: Compound/Generic73/Stoichiometry/1.0
participant stoichiometry: Compound/PW C000886/Stoichiometry/1.0
participant stoichiometry: Compound/Generic72/Stoichiometry/1.0
participant stoichiometry: Compound/PW C040034/Stoichiometry/1.0
right: Sulfite
right: oxidized thioredoxin
right: Hydrogen Ion
right: Adenosine 3',5'-diphosphate
spontaneous: false
EC number: 1.8.4.8
left: reduced thioredoxin
left: Phosphoadenosine phosphosulfate
name: Phosphoadenosine phosphosulfate + reduced thioredoxin → Adenosine 3',5'-diphosphate + Hydrogen Ion + Sulfite + oxidized thioredoxin
conversion direction: LEFT_TO_RIGHT

1.14.11.17
type: BiochemicalReaction
participant stoichiometry: Compound/PW C000162/Stoichiometry/1.0
participant stoichiometry: Compound/PW C040848/Stoichiometry/1.0
participant stoichiometry: Compound/PW C001316/Stoichiometry/1.0
participant stoichiometry: Compound/PW C001065/Stoichiometry/1.0
participant stoichiometry: Compound/PW C000174/Stoichiometry/1.0
participant stoichiometry: Compound/PW C000134/Stoichiometry/1.0
participant stoichiometry: Compound/PW C040034/Stoichiometry/1.0
participant stoichiometry: Compound/PW C000171/Stoichiometry/1.0
right: Succinic acid
right: Sulfite
right: Hydrogen Ion
right: Carbon dioxide
right: Aminoacetaldehyde
spontaneous: false
EC number: 1.14.11.17
left: Taurine
left: Oxoglutaric acid
left: Oxygen
name: Oxoglutaric acid + Oxygen + Taurine → Aminoacetaldehyde + Carbon dioxide + Hydrogen Ion + Succinic acid + Sulfite
conversion direction: LEFT_TO_RIGHT

Compound/PW C001118 Inner Membrane/Stoichiometry/1.0
type: Stoichiometry
physical entity: Sulfate
stoichiometric coefficient: 1.0

Reference/CAS 7418-61-3
type: UnificationXref
id: 7418-61-3
db: CAS

Reference/KEGG Compound C00224
type: UnificationXref
id: C00224
db: KEGG Compound

Reference/ChemSpider 1010
type: UnificationXref
id: 1010
db: ChemSpider

Reference/ChEBI CHEBI 15033
type: UnificationXref
id: CHEBI:15033
db: ChEBI

Compound/PW C000967/Stoichiometry/1.0
type: Stoichiometry
physical entity: βine aldehyde
stoichiometric coefficient: 1.0

Reference/BioCyc PPI
type: UnificationXref
id: PPI
db: BioCyc

2.8.1.1
type: BiochemicalReaction
participant stoichiometry: Compound/PW C000162/Stoichiometry/1.0
participant stoichiometry: Compound/PW C001399/Stoichiometry/1.0
participant stoichiometry: Compound/PW C001122/Stoichiometry/1.0
participant stoichiometry: Compound/PW C000176/Stoichiometry/1.0
participant stoichiometry: Compound/PW C040034/Stoichiometry/1.0
right: Thiocyanate
right: Sulfite
right: Hydrogen Ion
spontaneous: false
EC number: 2.8.1.1
left: Cyanide
left: Thiosulfate
name: Cyanide + Thiosulfate → Hydrogen Ion + Sulfite + Thiocyanate
conversion direction: LEFT_TO_RIGHT

Reference/CAS 5666-16-0
type: UnificationXref
id: 5666-16-0
db: CAS

2.5.1.47
type: BiochemicalReaction
participant stoichiometry: Compound/PW C000029/Stoichiometry/1.0
participant stoichiometry: Compound/PW C001755/Stoichiometry/1.0
participant stoichiometry: Compound/PW C000448/Stoichiometry/1.0
participant stoichiometry: Compound/PW C001827/Stoichiometry/1.0
participant stoichiometry: Compound/PW C040034/Stoichiometry/1.0
right: Hydrogen Ion
right: L-Cysteine
right: Acetic acid
spontaneous: false
EC number: 2.5.1.47
left: Hydrogen sulfide
left: O-Acetylserine
name: Hydrogen sulfide + O-Acetylserine ↔ Acetic acid + Hydrogen Ion + L-Cysteine
conversion direction: REVERSIBLE

1.8.1.2
type: BiochemicalReaction
participant stoichiometry: Compound/PW C001420/Stoichiometry/3.0
participant stoichiometry: Compound/PW C000162/Stoichiometry/1.0
participant stoichiometry: Compound/PW C040034/Stoichiometry/5.0
participant stoichiometry: Compound/PW C001827/Stoichiometry/1.0
participant stoichiometry: Compound/PW C000146/Stoichiometry/3.0
participant stoichiometry: Compound/PW C000143/Stoichiometry/1.0
right: Water
right: Hydrogen sulfide
right: NADP
spontaneous: false
EC number: 1.8.1.2
left: Sulfite
left: Hydrogen Ion
left: NADPH
name: 5 Hydrogen Ion + 3 NADPH + Sulfite → Hydrogen sulfide + NADP + 3 Water
conversion direction: LEFT_TO_RIGHT

Reference/HMDB HMDB0003276
type: UnificationXref
id: HMDB0003276
db: HMDB

Ammonium
type: SmallMolecule
entity reference: Ammonium

Hydrogen Ion
type: SmallMolecule
entity reference: Hydrogen Ion

Cytosol
type: CellularLocationVocabulary
xref: Reference/GENE ONTOLOGY GO 0005829

Adenosine triphosphate
type: SmallMolecule
entity reference: Adenosine triphosphate

Reference/BioCyc SUC
type: UnificationXref
id: SUC
db: BioCyc

FMNH2
type: SmallMolecule
entity reference: FMNH2

Reference/KEGG Compound C00009
type: UnificationXref
id: C00009
db: KEGG Compound

Reference/KEGG Compound C00008
type: UnificationXref
id: C00008
db: KEGG Compound

Reference/KEGG Compound C00007
type: UnificationXref
id: C00007
db: KEGG Compound

Reference/KEGG Compound C00006
type: UnificationXref
id: C00006
db: KEGG Compound

Reference/ChemSpider 5755
type: UnificationXref
id: 5755
db: ChemSpider

Reference/ChEBI CHEBI 18009
type: UnificationXref
id: CHEBI:18009
db: ChEBI

Phosphoadenosine phosphosulfate
type: SmallMolecule
entity reference: Phosphoadenosine phosphosulfate

Reference/KEGG Compound C00001
type: UnificationXref
id: C00001
db: KEGG Compound

Reference/ChEBI CHEBI 18361
type: UnificationXref
id: CHEBI:18361
db: ChEBI

Reference/KEGG Compound C00005
type: UnificationXref
id: C00005
db: KEGG Compound

Reference/ChEBI CHEBI 18367
type: UnificationXref
id: CHEBI:18367
db: ChEBI

Taurine
type: SmallMolecule
cellular location: Cytosol
entity reference: Taurine

Reference/ChEBI CHEBI 16189
type: UnificationXref
id: CHEBI:16189
db: ChEBI

Reference/ChemSpider 1032
type: UnificationXref
id: 1032
db: ChemSpider

Reference/KEGG Compound C00245
type: UnificationXref
id: C00245
db: KEGG Compound

Reference/KEGG Compound C00002
type: UnificationXref
id: C00002
db: KEGG Compound

Reference/ChemSpider 1031
type: UnificationXref
id: 1031
db: ChemSpider

Reference/BioCyc APS
type: UnificationXref
id: APS
db: BioCyc

Reference/ChemSpider 559060
type: UnificationXref
id: 559060
db: ChemSpider

3-mercaptopyruvate sulfurtransferase
type: Protein
entity reference: 3-mercaptopyruvate sulfurtransferase

Compound/PW C000176/Stoichiometry/1.0
type: Stoichiometry
physical entity: Thiosulfate
stoichiometric coefficient: 1.0

Reference/HMDB HMDB0002084
type: UnificationXref
id: HMDB0002084
db: HMDB

1.14.14.5
type: BiochemicalReaction
participant stoichiometry: Compound/PW C000967/Stoichiometry/1.0
participant stoichiometry: Compound/PW C000162/Stoichiometry/1.0
participant stoichiometry: Compound/PW C001420/Stoichiometry/1.0
participant stoichiometry: Compound/PW C001065/Stoichiometry/1.0
participant stoichiometry: Compound/PW C000891/Stoichiometry/1.0
participant stoichiometry: Compound/PW C001170/Stoichiometry/1.0
participant stoichiometry: Compound/PW C042929/Stoichiometry/1.0
participant stoichiometry: Compound/PW C040034/Stoichiometry/1.0
right: Sulfite
right: Water
right: Hydrogen Ion
right: Flavin Mononucleotide
right: βine aldehyde
spontaneous: false
EC number: 1.14.14.5
left: FMNH2
left: Oxygen
left: methanesulfonate
name: FMNH2 + Oxygen + methanesulfonate → Flavin Mononucleotide + Hydrogen Ion + Sulfite + Water + βine aldehyde
conversion direction: LEFT_TO_RIGHT

Compound/PW C001118/Stoichiometry/1.0
type: Stoichiometry
physical entity: Sulfate
stoichiometric coefficient: 1.0

2-Aminoacrylic acid
type: SmallMoleculeReference
xref: Reference/ChemSpider 110510
xref: Reference/CAS 1948-56-7
xref: Reference/KEGG Compound C02218
xref: Reference/HMDB HMDB0003609
xref: Reference/PubChem-compound 123991
xref: Reference/ChEBI CHEBI 17123
chemical formula: C3H5NO2
molecular weight: 87.03203
structure: ChemicalStructure/PW C001938

βine aldehyde
type: SmallMoleculeReference
xref: Reference/ChemSpider 244
xref: Reference/ChEBI CHEBI 15710
xref: Reference/PubChem-compound 249
xref: Reference/BioCyc BETAINE ALDEHYDE
xref: Reference/CAS 7418-61-3
xref: Reference/HMDB HMDB0001252
xref: Reference/KEGG Compound C00576
chemical formula: C5H12NO
molecular weight: 102.09189
structure: ChemicalStructure/PW C000967

Glycolysis and Pyruvate Dehydrogenase
type: Pathway
pathway order: SubPathwayInteractionSteps/SubPathway475108
pathway component: SubPathwayInteraction475108
xref: Reference/PathWhiz PW000785
xref: Reference/SMPDB SMP0000807
name: SubPathway

Reference/ChemSpider 1068
type: UnificationXref
id: 1068
db: ChemSpider

Reference/KEGG Compound C01342
type: UnificationXref
id: C01342
db: KEGG Compound

Reference/KEGG Compound C00011
type: UnificationXref
id: C00011
db: KEGG Compound

Reference/ChEBI CHEBI 17123
type: UnificationXref
id: CHEBI:17123
db: ChEBI

Reference/KEGG Compound C00013
type: UnificationXref
id: C00013
db: KEGG Compound

Reference/BioCyc NAD(P)
type: UnificationXref
id: NAD(P)
db: BioCyc

Sulfate
type: SmallMolecule
cellular location: Inner Membrane
entity reference: Sulfate

Hydrogen sulfide
type: SmallMoleculeReference
xref: Reference/ChEBI CHEBI 16136
xref: Reference/BioCyc HS
xref: Reference/KEGG Compound C00283
xref: Reference/PubChem-compound 18779926
xref: Reference/CAS 7783-06-4
xref: Reference/ChemSpider 391
xref: Reference/HMDB HMDB0003276
chemical formula: H2S
molecular weight: 33.98772
structure: ChemicalStructure/PW C001827

Reference/ChEBI CHEBI 16048
type: UnificationXref
id: CHEBI:16048
db: ChEBI

Hydrogen Ion
type: SmallMoleculeReference
xref: Reference/KEGG Compound C00080
xref: Reference/ChEBI CHEBI 15378
xref: Reference/HMDB HMDB0059597
xref: Reference/PubChem-compound 1038
xref: Reference/ChemSpider 1010
chemical formula: H
molecular weight: 1.007825
structure: ChemicalStructure/PW C040034

Compound/PW C001399/Stoichiometry/1.0
type: Stoichiometry
physical entity: Cyanide
stoichiometric coefficient: 1.0

tryptophanase / L-cysteine desulfhydrase
type: Complex
component stoichiometry: Protein/28277/Stoichiometry/4.0
component: Unknown

Reference/KEGG Compound C00022
type: UnificationXref
id: C00022
db: KEGG Compound

Sulfur Metabolism (Methanesulfonate)
type: Pathway
pathway order: PathwayEnzymeReaction/6446685
pathway order: PathwayEnzymeReaction/6446676
pathway order: PathwayEnzymeReaction/6446687
pathway order: PathwayEnzymeReaction/6446698
pathway order: PathwayEnzymeReaction/6446664
pathway order: PathwayEnzymeReaction/6446686
pathway order: PathwayEnzymeReaction/6446697
pathway order: PathwayEnzymeReaction/6446681
pathway order: PathwayEnzymeReaction/6446680
pathway order: PathwayEnzymeReaction/6446672
pathway order: PathwayEnzymeReaction/6446706
pathway order: PathwayEnzymeReaction/6446705
pathway order: PathwayEnzymeReaction/6446689
pathway order: PathwayEnzymeReaction/6446700
pathway order: PathwayEnzymeReaction/6446688
pathway order: PathwayEnzymeReaction/6446702
pathway order: PathwayEnzymeReaction/6446668
pathway order: PathwaySubPathway/475108
pathway order: PathwayEnzymeReaction/6446707
pathway order: PathwayTransport/6446709
pathway order: PathwayEnzymeReaction/6446690
pathway component: Glycolysis and Pyruvate Dehydrogenase
pathway component: Reaction2902
pathway component: Reaction2903
pathway component: ReactionCatalysis1053367
pathway component: ReactionCoupledTransport16868
pathway component: ReactionCatalysis734409
pathway component: 2.7.7.4
pathway component: Transport66598
pathway component: 3.1.3.7
pathway component: Reaction1033291
pathway component: ReactionCatalysis1053252
pathway component: ReactionCatalysis1053251
pathway component: ReactionCatalysis1053254
pathway component: 1.8.4.8
pathway component: ReactionCatalysis1053253
pathway component: 1.14.11.17
pathway component: ReactionCoupledTransport20285
pathway component: TransportCatalysis47159
pathway component: ReactionCatalysis734410
pathway component: ReactionCatalysis1053259
pathway component: ReactionCoupledTransportCatalysis16930
pathway component: ReactionCatalysis1053256
pathway component: ReactionCatalysis1053258
pathway component: ReactionCatalysis1053257
pathway component: 2.7.1.25
pathway component: 2.8.1.1
pathway component: ReactionCatalysis1053262
pathway component: ReactionCatalysis1053265
pathway component: ReactionCatalysis1053264
pathway component: 1.14.14.5
pathway component: 2.5.1.47
pathway component: 1.8.1.2
pathway component: ReactionCatalysis1053260
pathway component: ReactionCoupledTransportCatalysis20347
xref: Reference/SMPDB SMP0441037
xref: Reference/PathWhiz PW457168
organism: Escherichia coli O111:H- str. 11128

Reference/CAS 56-65-5
type: UnificationXref
id: 56-65-5
db: CAS

Reference/ChemSpider 5653
type: UnificationXref
id: 5653
db: ChemSpider

Reference/KEGG Compound C00026
type: UnificationXref
id: C00026
db: KEGG Compound

SubPathwayInteraction475108
type: Interaction
name: SubPathway475108Reaction
name: SubPathwayReaction
participant: Pyruvic acid

Reference/ChemSpider 1054
type: UnificationXref
id: 1054
db: ChemSpider

Reference/BioCyc ACET
type: UnificationXref
id: ACET
db: BioCyc

Reference/CAS 482-67-7
type: UnificationXref
id: 482-67-7
db: CAS

Compound/PW C000143/Stoichiometry/1.0
type: Stoichiometry
physical entity: NADP
stoichiometric coefficient: 1.0

Escherichia coli O111:H- str. 11128
type: BioSource
xref: Reference/TAXONOMY 585396

Reference/KEGG Compound C02218
type: UnificationXref
id: C02218
db: KEGG Compound

Reference/ChEBI CHEBI 16094
type: UnificationXref
id: CHEBI:16094
db: ChEBI

Reference/CAS 52-90-4
type: UnificationXref
id: 52-90-4
db: CAS

Reference/KEGG Compound C00033
type: UnificationXref
id: C00033
db: KEGG Compound

ChemicalStructure/PW C042929
type: ChemicalStructure
structure format: SMILES
structure data: CS([O-])(=O)=O

O-Acetylserine
type: SmallMoleculeReference
xref: Reference/PubChem-compound 6971051
xref: Reference/ChemSpider 89874
xref: Reference/KEGG Compound C00979
xref: Reference/BioCyc ACETYLSERINE
xref: Reference/CAS 5147-00-2
xref: Reference/ChEBI CHEBI 17981
xref: Reference/HMDB HMDB0003011
chemical formula: C5H9NO4
molecular weight: 147.05316
structure: ChemicalStructure/PW C001755

Reference/SMPDB SMP0000807
type: UnificationXref
id: SMP0000807
db: SMPDB

ChemicalStructure/PW C000176
type: ChemicalStructure
structure format: SMILES
structure data: OS(S)(=O)=O

Reference/CAS 328-50-7
type: UnificationXref
id: 328-50-7
db: CAS

Reference/HMDB HMDB0000254
type: UnificationXref
id: HMDB0000254
db: HMDB

Reference/HMDB HMDB0000257
type: UnificationXref
id: HMDB0000257
db: HMDB

Water
type: SmallMolecule
entity reference: Water

ChemicalStructure/PW C000174
type: ChemicalStructure
structure format: SMILES
structure data: OC(=O)CCC(O)=O

Reference/KEGG Compound C00283
type: UnificationXref
id: C00283
db: KEGG Compound

Adenosine phosphosulfate
type: SmallMoleculeReference
xref: Reference/HMDB HMDB0001003
xref: Reference/CAS 485-84-7
xref: Reference/BioCyc APS
xref: Reference/ChemSpider 9821
xref: Reference/PubChem-compound 10238
xref: Reference/KEGG Compound C00224
xref: Reference/ChEBI CHEBI 17709
chemical formula: C10H14N5O10PS
molecular weight: 427.0199
structure: ChemicalStructure/PW C000793

Reference/HMDB HMDB0000251
type: UnificationXref
id: HMDB0000251
db: HMDB

Reference/HMDB HMDB0000250
type: UnificationXref
id: HMDB0000250
db: HMDB

ChemicalStructure/PW C000171
type: ChemicalStructure
structure format: SMILES
structure data: NCCS(O)(=O)=O

ChemicalStructure/PW C000170
type: ChemicalStructure
structure format: SMILES
structure data: OP(O)(=O)OP(O)(O)=O

Reference/HMDB HMDB0001341
type: UnificationXref
id: HMDB0001341
db: HMDB

Reference/TAXONOMY 585396
type: UnificationXref
id: 585396
db: TAXONOMY

Reference/PubChem-compound 85257
type: UnificationXref
id: 85257
db: PubChem-compound

Reference/PubChem-compound 10238
type: UnificationXref
id: 10238
db: PubChem-compound

Reference/KEGG Compound C00042
type: UnificationXref
id: C00042
db: KEGG Compound

L-Cysteine
type: SmallMolecule
entity reference: L-Cysteine

ChemicalStructure/PW C001034
type: ChemicalStructure
structure format: SMILES

Compound/PW C000170/Stoichiometry/1.0
type: Stoichiometry
physical entity: Pyrophosphate
stoichiometric coefficient: 1.0

ChemicalStructure/PW C001399
type: ChemicalStructure
structure format: SMILES
structure data: C#[N-]

Reference/BioCyc SO3
type: UnificationXref
id: SO3
db: BioCyc

Phosphoadenosine phosphosulfate
type: SmallMoleculeReference
xref: Reference/BioCyc PAPS
xref: Reference/HMDB HMDB0001134
xref: Reference/CAS 482-67-7
xref: Reference/ChemSpider 9799
xref: Reference/KEGG Compound C00053
xref: Reference/PubChem-compound 10214
xref: Reference/ChEBI CHEBI 17980
chemical formula: C10H15N5O13P2S
molecular weight: 506.98624
structure: ChemicalStructure/PW C000886

Reference/KEGG Compound C00177
type: UnificationXref
id: C00177
db: KEGG Compound

Reference/ChemSpider 140102
type: UnificationXref
id: 140102
db: ChemSpider

ChemicalStructure/PW C001118
type: ChemicalStructure
structure format: SMILES
structure data: OS(O)(=O)=O

ChemicalStructure/PW C000029
type: ChemicalStructure
structure format: SMILES
structure data: CC(O)=O

Reference/KEGG Compound C00054
type: UnificationXref
id: C00054
db: KEGG Compound

Reference/KEGG Compound C00053
type: UnificationXref
id: C00053
db: KEGG Compound

Reference/CAS 7732-18-5
type: UnificationXref
id: 7732-18-5
db: CAS

Compound/PW C000164/Stoichiometry/1.0
type: Stoichiometry
physical entity: Pyruvic acid
stoichiometric coefficient: 1.0

Reference/KEGG Compound C00059
type: UnificationXref
id: C00059
db: KEGG Compound

Unknown
type: Protein
cellular location: Inner Membrane
entity reference: Unknown

Reference/PathWhiz PW457168
type: UnificationXref
id: PW457168
db: PathWhiz

Reference/HMDB HMDB0001003
type: UnificationXref
id: HMDB0001003
db: HMDB

ChemicalStructure/PW C001122
type: ChemicalStructure
structure format: SMILES
structure data: [S-]C#N

O-acetylserine sulfhydrylase A
type: Complex
component stoichiometry: Protein/28277/Stoichiometry/2.0
component: Unknown

2-iminopropanoate
type: SmallMolecule
entity reference: 2-iminopropanoate

Adenosine phosphosulfate
type: SmallMolecule
entity reference: Adenosine phosphosulfate

sulfite reductase
type: Complex
component stoichiometry: Protein/28277/Stoichiometry/8.0
component: Unknown

Reference/KEGG Compound C00061
type: UnificationXref
id: C00061
db: KEGG Compound

FMNH2
type: SmallMoleculeReference
xref: Reference/ChEBI CHEBI 16048
xref: Reference/BioCyc FMNH2
xref: Reference/KEGG Compound C01847
xref: Reference/PubChem-compound 445395
xref: Reference/CAS 5666-16-0
xref: Reference/ChemSpider 393046
xref: Reference/HMDB HMDB0001142
chemical formula: C17H23N4O9P
molecular weight: 458.12027
structure: ChemicalStructure/PW C000891

Compound/PW C000029/Stoichiometry/1.0
type: Stoichiometry
physical entity: Acetic acid
stoichiometric coefficient: 1.0

Reference/CAS 146-17-8
type: UnificationXref
id: 146-17-8
db: CAS

Adenosine triphosphate
type: SmallMoleculeReference
xref: Reference/ChEBI CHEBI 15422
xref: Reference/PubChem-compound 5957
xref: Reference/HMDB HMDB0000538
xref: Reference/CAS 56-65-5
xref: Reference/ChemSpider 5742
xref: Reference/BioCyc ATP
xref: Reference/KEGG Compound C00002
chemical formula: C10H16N5O13P3
molecular weight: 506.99576
structure: ChemicalStructure/PW C000414

Reference/ChEBI CHEBI 18022
type: UnificationXref
id: CHEBI:18022
db: ChEBI

Compound/Generic72/Stoichiometry/1.0
type: Stoichiometry
physical entity: oxidized thioredoxin
stoichiometric coefficient: 1.0

Reference/PubChem-compound 10214
type: UnificationXref
id: 10214
db: PubChem-compound

O-Acetylserine
type: SmallMolecule
entity reference: O-Acetylserine

Reference/CAS 485-84-7
type: UnificationXref
id: 485-84-7
db: CAS

Reference/HMDB HMDB0001377
type: UnificationXref
id: HMDB0001377
db: HMDB

Reference/HMDB HMDB0001134
type: UnificationXref
id: HMDB0001134
db: HMDB

ChemicalStructure/PW C000164
type: ChemicalStructure
structure format: SMILES
structure data: CC(=O)C(O)=O

ChemicalStructure/PW C000043
type: ChemicalStructure
structure format: SMILES

ChemicalStructure/PW C000162
type: ChemicalStructure
structure format: SMILES
structure data: OS(O)=O

Unknown
type: ProteinReference

Reference/HMDB HMDB0000042
type: UnificationXref
id: HMDB0000042
db: HMDB

Reference/HMDB HMDB0001252
type: UnificationXref
id: HMDB0001252
db: HMDB

Reference/PubChem-compound 962
type: UnificationXref
id: 962
db: PubChem-compound

Reference/ChemSpider 5800
type: UnificationXref
id: 5800
db: ChemSpider

Carbon dioxide
type: SmallMoleculeReference
xref: Reference/PubChem-compound 280
xref: Reference/ChEBI CHEBI 16526
xref: Reference/ChemSpider 274
xref: Reference/HMDB HMDB0001967
xref: Reference/CAS 124-38-9
xref: Reference/KEGG Compound C00011
chemical formula: CO2
molecular weight: 43.98983
structure: ChemicalStructure/PW C001316

Phosphate
type: SmallMolecule
entity reference: Phosphate

Reference/KEGG Compound C00080
type: UnificationXref
id: C00080
db: KEGG Compound

Reference/ChEBI CHEBI 77456
type: UnificationXref
id: CHEBI:77456
db: ChEBI

ChemicalStructure/PW C001065
type: ChemicalStructure
structure format: SMILES
structure data: O=O

Periplasmic Space
type: CellularLocationVocabulary
xref: Reference/GENE ONTOLOGY GO 0005620

Oxoglutaric acid
type: SmallMolecule
entity reference: Oxoglutaric acid

Compound/Generic73/Stoichiometry/1.0
type: Stoichiometry
physical entity: reduced thioredoxin
stoichiometric coefficient: 1.0

Reference/HMDB HMDB0002111
type: UnificationXref
id: HMDB0002111
db: HMDB

Reference/HMDB HMDB0001142
type: UnificationXref
id: HMDB0001142
db: HMDB

Compound/PW C000793/Stoichiometry/1.0
type: Stoichiometry
physical entity: Adenosine phosphosulfate
stoichiometric coefficient: 1.0

Reference/CAS 14265-44-2
type: UnificationXref
id: 14265-44-2
db: CAS

Reference/BioCyc PYRUVATE
type: UnificationXref
id: PYRUVATE
db: BioCyc

Reference/CAS 58-64-0
type: UnificationXref
id: 58-64-0
db: CAS

Reference/PubChem-compound 9322
type: UnificationXref
id: 9322
db: PubChem-compound

Compound/PW C040034 Inner Membrane/Stoichiometry/1.0
type: Stoichiometry
physical entity: Hydrogen Ion
stoichiometric coefficient: 1.0

Reference/KEGG Compound C00094
type: UnificationXref
id: C00094
db: KEGG Compound

Reference/BioCyc ACETYLSERINE
type: UnificationXref
id: ACETYLSERINE
db: BioCyc

Reference/HMDB HMDB0000061
type: UnificationXref
id: HMDB0000061
db: HMDB

Reference/PubChem-compound 644102
type: UnificationXref
id: 644102
db: PubChem-compound

L-Cysteine
type: SmallMoleculeReference
xref: Reference/HMDB HMDB0000574
xref: Reference/CAS 52-90-4
xref: Reference/KEGG Compound C00097
xref: Reference/BioCyc CYS
xref: Reference/ChemSpider 5653
xref: Reference/PubChem-compound 5862
xref: Reference/ChEBI CHEBI 17561
chemical formula: C3H7NO2S
molecular weight: 121.01975
structure: ChemicalStructure/PW C000448

Taurine
type: SmallMolecule
cellular location: Periplasmic Space
entity reference: Taurine

ChemicalStructure/PW C040848
type: ChemicalStructure
structure format: SMILES
structure data: NCC=O

Reference/KEGG Compound C00097
type: UnificationXref
id: C00097
db: KEGG Compound

Compound/PW C000171/Stoichiometry/1.0
type: Stoichiometry
physical entity: Taurine
stoichiometric coefficient: 1.0

Reference/PubChem-compound 22833512
type: UnificationXref
id: 22833512
db: PubChem-compound

Water
type: SmallMoleculeReference
xref: Reference/PubChem-compound 962
xref: Reference/ChEBI CHEBI 15377
xref: Reference/KEGG Compound C00001
xref: Reference/ChemSpider 937
xref: Reference/HMDB HMDB0002111
xref: Reference/CAS 7732-18-5
chemical formula: H2O
molecular weight: 18.010565
structure: ChemicalStructure/PW C001420

Reference/CAS 57-12-5
type: UnificationXref
id: 57-12-5
db: CAS

Reference/ChemSpider 393046
type: UnificationXref
id: 393046
db: ChemSpider

Reference/CAS 14265-45-3
type: UnificationXref
id: 14265-45-3
db: CAS

Reference/PubChem-compound 977
type: UnificationXref
id: 977
db: PubChem-compound

Reference/HMDB HMDB0059597
type: UnificationXref
id: HMDB0059597
db: HMDB

Reference/HMDB HMDB0041827
type: UnificationXref
id: HMDB0041827
db: HMDB

Carbon dioxide
type: SmallMolecule
entity reference: Carbon dioxide

Reference/ChemSpider 110510
type: UnificationXref
id: 110510
db: ChemSpider

Adenosine diphosphate
type: SmallMolecule
cellular location: Inner Membrane
entity reference: Adenosine diphosphate

Compound/PW C001104 Inner Membrane/Stoichiometry/1.0
type: Stoichiometry
physical entity: Phosphate
stoichiometric coefficient: 1.0

ChemicalStructure/PW C001170
type: ChemicalStructure
structure format: SMILES

Reference/ChemSpider 17215925
type: UnificationXref
id: 17215925
db: ChemSpider

Acetic acid
type: SmallMoleculeReference
xref: Reference/ChEBI CHEBI 15366
xref: Reference/BioCyc ACET
xref: Reference/CAS 64-19-7
xref: Reference/KEGG Compound C00033
xref: Reference/ChemSpider 171
xref: Reference/HMDB HMDB0000042
xref: Reference/PubChem-compound 176
chemical formula: C2H4O2
molecular weight: 60.02113
structure: ChemicalStructure/PW C000029

Reaction2902
type: BiochemicalReaction
participant stoichiometry: Compound/PW C040928/Stoichiometry/1.0
participant stoichiometry: Compound/PW C001938/Stoichiometry/1.0
right: 2-iminopropanoate
spontaneous: true
left: 2-Aminoacrylic acid
name: 2-Aminoacrylic acid → 2-iminopropanoate
conversion direction: LEFT_TO_RIGHT

Reference/PubChem-compound 249
type: UnificationXref
id: 249
db: PubChem-compound

Reaction2903
type: BiochemicalReaction
participant stoichiometry: Compound/PW C040928/Stoichiometry/1.0
participant stoichiometry: Compound/PW C022608/Stoichiometry/1.0
participant stoichiometry: Compound/PW C001420/Stoichiometry/1.0
participant stoichiometry: Compound/PW C000164/Stoichiometry/1.0
participant stoichiometry: Compound/PW C040034/Stoichiometry/1.0
right: Ammonium
right: Pyruvic acid
spontaneous: true
left: Water
left: 2-iminopropanoate
left: Hydrogen Ion
name: 2-iminopropanoate + Hydrogen Ion + Water → Ammonium + Pyruvic acid
conversion direction: LEFT_TO_RIGHT

ChemicalStructure/PW C000448
type: ChemicalStructure
structure format: SMILES
structure data: N[C@@H](CS)C(O)=O

Compound/PW C042929/Stoichiometry/1.0
type: Stoichiometry
physical entity: methanesulfonate
stoichiometric coefficient: 1.0

Sulfate
type: SmallMoleculeReference
xref: Reference/BioCyc NH42SO4
xref: Reference/CAS 14808-79-8
xref: Reference/PubChem-compound 1117
xref: Reference/HMDB HMDB0001448
xref: Reference/ChemSpider 1085
xref: Reference/KEGG Compound C00059
xref: Reference/ChEBI CHEBI 16189
chemical formula: H2O4S
molecular weight: 97.96738
structure: ChemicalStructure/PW C001118

Reference/PubChem-compound 5975
type: UnificationXref
id: 5975
db: PubChem-compound

Aminoacetaldehyde
type: SmallMoleculeReference
xref: Reference/ChEBI CHEBI 17628
chemical formula: C2H5NO
molecular weight: 59.037113
structure: ChemicalStructure/PW C040848

Succinic acid
type: SmallMolecule
entity reference: Succinic acid

Taurine
type: SmallMolecule
entity reference: Taurine

Thiocyanate
type: SmallMoleculeReference
xref: Reference/HMDB HMDB0001453
xref: Reference/KEGG Compound C01755
xref: Reference/CAS 302-04-5
xref: Reference/ChEBI CHEBI 18022
xref: Reference/ChemSpider 8961
xref: Reference/PubChem-compound 9322
xref: Reference/BioCyc HSCN
chemical formula: CNS
molecular weight: 57.975143
structure: ChemicalStructure/PW C001122

Reference/CAS 64-19-7
type: UnificationXref
id: 64-19-7
db: CAS

Thiosulfate
type: SmallMolecule
entity reference: Thiosulfate

ChemicalStructure/PW C001420
type: ChemicalStructure
structure format: SMILES
structure data: O

Pyrophosphate
type: SmallMolecule
entity reference: Pyrophosphate

Reference/CAS 5147-00-2
type: UnificationXref
id: 5147-00-2
db: CAS

Reference/HMDB HMDB0000538
type: UnificationXref
id: HMDB0000538
db: HMDB

Reference/PubChem-compound 1123
type: UnificationXref
id: 1123
db: PubChem-compound

methanesulfonate
type: SmallMolecule
entity reference: methanesulfonate

Compound/PW C001034 Inner Membrane/Stoichiometry/1.0
type: Stoichiometry
physical entity: Adenosine diphosphate
stoichiometric coefficient: 1.0

Sulfite
type: SmallMolecule
entity reference: Sulfite

Compound/PW C000414/Stoichiometry/1.0
type: Stoichiometry
physical entity: Adenosine triphosphate
stoichiometric coefficient: 1.0

Reference/ChemSpider 244
type: UnificationXref
id: 244
db: ChemSpider

Reference/ChemSpider 89874
type: UnificationXref
id: 89874
db: ChemSpider

Reference/PubChem-compound 51
type: UnificationXref
id: 51
db: PubChem-compound

Pyruvic acid
type: SmallMolecule
entity reference: Pyruvic acid
name: SubPathwayInput

Adenosine 3',5'-diphosphate
type: SmallMolecule
entity reference: Adenosine 3',5'-diphosphate

Reference/BioCyc ADP
type: UnificationXref
id: ADP
db: BioCyc

Pyruvic acid
type: SmallMoleculeReference
xref: Reference/PubChem-compound 1060
xref: Reference/HMDB HMDB0000243
xref: Reference/CAS 127-17-3
xref: Reference/BioCyc PYRUVATE
xref: Reference/KEGG Compound C00022
xref: Reference/ChEBI CHEBI 32816
xref: Reference/ChemSpider 1031
chemical formula: C3H4O3
molecular weight: 88.016045
structure: ChemicalStructure/PW C000164

Adenosine 3',5'-diphosphate
type: SmallMoleculeReference
xref: Reference/ChEBI CHEBI 17985
xref: Reference/CAS 1053-73-2
xref: Reference/PubChem-compound 159296
xref: Reference/ChemSpider 140102
xref: Reference/BioCyc 3-5-ADP
xref: Reference/KEGG Compound C00054
xref: Reference/HMDB HMDB0000061
chemical formula: C10H15N5O10P2
molecular weight: 427.02942
structure: ChemicalStructure/PW C000043

Sulfite
type: SmallMoleculeReference
xref: Reference/CAS 14265-45-3
xref: Reference/BioCyc SO3
xref: Reference/ChEBI CHEBI 17359
xref: Reference/ChemSpider 1068
xref: Reference/KEGG Compound C00094
xref: Reference/HMDB HMDB0000240
xref: Reference/PubChem-compound 1099
chemical formula: H2O3S
molecular weight: 81.972466
structure: ChemicalStructure/PW C000162

Compound/PW C040848/Stoichiometry/1.0
type: Stoichiometry
physical entity: Aminoacetaldehyde
stoichiometric coefficient: 1.0

Compound/PW C001122/Stoichiometry/1.0
type: Stoichiometry
physical entity: Thiocyanate
stoichiometric coefficient: 1.0

Reference/CAS 53-59-8
type: UnificationXref
id: 53-59-8
db: CAS

ChemicalStructure/PW C001755
type: ChemicalStructure
structure format: SMILES
structure data: CC(=O)OC[C@H](N)C(O)=O

Reference/PubChem-compound 1038
type: UnificationXref
id: 1038
db: PubChem-compound

2.7.7.4
type: BiochemicalReaction
participant stoichiometry: Compound/PW C000414/Stoichiometry/1.0
participant stoichiometry: Compound/PW C000793/Stoichiometry/1.0
participant stoichiometry: Compound/PW C000170/Stoichiometry/1.0
participant stoichiometry: Compound/PW C040034/Stoichiometry/1.0
participant stoichiometry: Compound/PW C001118/Stoichiometry/1.0
right: Adenosine phosphosulfate
right: Pyrophosphate
spontaneous: false
EC number: 2.7.7.4
left: Hydrogen Ion
left: Sulfate
left: Adenosine triphosphate
name: Adenosine triphosphate + Hydrogen Ion + Sulfate → Adenosine phosphosulfate + Pyrophosphate
conversion direction: LEFT_TO_RIGHT

ChemicalStructure/PW C040928
type: ChemicalStructure
structure format: SMILES
structure data: CC(=N)C([O-])=O

methanesulfonate
type: SmallMoleculeReference
xref: Reference/PubChem-compound 85257
xref: Reference/ChEBI CHEBI 25224
chemical formula: CH3O3S
molecular weight: 94.980835
structure: ChemicalStructure/PW C042929

Reference/HMDB HMDB0001520
type: UnificationXref
id: HMDB0001520
db: HMDB

Thiocyanate
type: SmallMolecule
entity reference: Thiocyanate

Reference/BioCyc FMN
type: UnificationXref
id: FMN
db: BioCyc

Reference/GENE ONTOLOGY GO 0005829
type: UnificationXref
id: GO:0005829
db: GENE ONTOLOGY

ChemicalStructure/PW C000793
type: ChemicalStructure
structure format: SMILES

Reference/ChemSpider 274
type: UnificationXref
id: 274
db: ChemSpider

thiosulfate sulfurtransferase
type: Complex
component stoichiometry: Protein/28277/Stoichiometry/2.0
component: Unknown
component: 3-mercaptopyruvate sulfurtransferase

Oxoglutaric acid
type: SmallMoleculeReference
xref: Reference/CAS 328-50-7
xref: Reference/PubChem-compound 51
xref: Reference/BioCyc 2-KETOGLUTARATE
xref: Reference/HMDB HMDB0000208
xref: Reference/ChEBI CHEBI 30915
xref: Reference/KEGG Compound C00026
xref: Reference/ChemSpider 50
chemical formula: C5H6O5
molecular weight: 146.02153
structure: ChemicalStructure/PW C000134

Reference/ChemSpider 391
type: UnificationXref
id: 391
db: ChemSpider

alkanesulfonate monooxygenase, FMNH2-dependent
type: Complex
component stoichiometry: Protein/28277/Stoichiometry/4.0
component: Unknown

Unknown
type: Protein
entity reference: Unknown

Compound/PW C000448/Stoichiometry/1.0
type: Stoichiometry
physical entity: L-Cysteine
stoichiometric coefficient: 1.0

Reference/ChEBI CHEBI 15710
type: UnificationXref
id: CHEBI:15710
db: ChEBI

Reference/PubChem-compound 445395
type: UnificationXref
id: 445395
db: PubChem-compound

Sulfate
type: SmallMolecule
entity reference: Sulfate

Phosphate
type: SmallMoleculeReference
xref: Reference/KEGG Compound C00009
xref: Reference/PubChem-compound 1061
xref: Reference/CAS 14265-44-2
xref: Reference/HMDB HMDB0001429
xref: Reference/BioCyc CPD-8587
xref: Reference/ChEBI CHEBI 18367
xref: Reference/ChemSpider 1032
chemical formula: H3O4P
molecular weight: 97.9769
structure: ChemicalStructure/PW C001104

NADPH
type: SmallMolecule
entity reference: NADPH

Reference/PubChem-compound 5862
type: UnificationXref
id: 5862
db: PubChem-compound

Acetic acid
type: SmallMolecule
entity reference: Acetic acid

Reference/GENE ONTOLOGY GO 0070258
type: UnificationXref
id: GO:0070258
db: GENE ONTOLOGY

2.7.1.25
type: BiochemicalReaction
participant stoichiometry: Compound/PW C000414/Stoichiometry/1.0
participant stoichiometry: Compound/PW C000793/Stoichiometry/1.0
participant stoichiometry: Compound/PW C001034/Stoichiometry/1.0
participant stoichiometry: Compound/PW C000886/Stoichiometry/1.0
participant stoichiometry: Compound/PW C040034/Stoichiometry/1.0
right: Adenosine diphosphate
right: Hydrogen Ion
right: Phosphoadenosine phosphosulfate
spontaneous: false
EC number: 2.7.1.25
left: Adenosine phosphosulfate
left: Adenosine triphosphate
name: Adenosine phosphosulfate + Adenosine triphosphate → Adenosine diphosphate + Hydrogen Ion + Phosphoadenosine phosphosulfate
conversion direction: LEFT_TO_RIGHT

Reference/CAS 1948-56-7
type: UnificationXref
id: 1948-56-7
db: CAS

NADP
type: SmallMolecule
entity reference: NADP

NADPH
type: SmallMoleculeReference
xref: Reference/CAS 53-57-6
xref: Reference/HMDB HMDB0000221
xref: Reference/PubChem-compound 22833512
xref: Reference/BioCyc NADPH
xref: Reference/ChemSpider 17215925
xref: Reference/KEGG Compound C00005
xref: Reference/ChEBI CHEBI 16474
chemical formula: C21H30N7O17P3
molecular weight: 745.0911
structure: ChemicalStructure/PW C000146

Reference/CAS 302-04-5
type: UnificationXref
id: 302-04-5
db: CAS

Reference/BioCyc 3-5-ADP
type: UnificationXref
id: 3-5-ADP
db: BioCyc

NADP
type: SmallMoleculeReference
xref: Reference/KEGG Compound C00006
xref: Reference/CAS 53-59-8
xref: Reference/BioCyc NAD(P)
xref: Reference/HMDB HMDB0000217
xref: Reference/ChEBI CHEBI 18009
xref: Reference/PubChem-compound 5886
xref: Reference/ChemSpider 5675
chemical formula: C21H28N7O17P3
molecular weight: 743.07544
structure: ChemicalStructure/PW C000143

Reference/BioCyc NADPH
type: UnificationXref
id: NADPH
db: BioCyc

oxidized thioredoxin
type: SmallMolecule
entity reference: oxidized thioredoxin

reduced thioredoxin
type: SmallMolecule
entity reference: reduced thioredoxin

Reference/CAS 1053-73-2
type: UnificationXref
id: 1053-73-2
db: CAS

Reference/PathWhiz PW000785
type: UnificationXref
id: PW000785
db: PathWhiz

ReactionCoupledTransport16868
type: TransportWithBiochemicalReaction
participant stoichiometry: Compound/PW C001118 Inner Membrane/Stoichiometry/1.0
participant stoichiometry: Compound/PW C040034 Inner Membrane/Stoichiometry/1.0
participant stoichiometry: Compound/PW C000414 Inner Membrane/Stoichiometry/1.0
participant stoichiometry: Compound/PW C001420 Inner Membrane/Stoichiometry/1.0
participant stoichiometry: Compound/PW C001034 Inner Membrane/Stoichiometry/1.0
participant stoichiometry: Compound/PW C001104 Inner Membrane/Stoichiometry/1.0
right: Phosphate
right: Adenosine diphosphate
right: Sulfate
right: Hydrogen Ion
spontaneous: false
left: Water
left: Adenosine triphosphate
left: Sulfate
name: Adenosine triphosphate + Sulfate + Water → Adenosine diphosphate + Hydrogen Ion + Phosphate + Sulfate
conversion direction: LEFT_TO_RIGHT

Reference/HMDB HMDB0000208
type: UnificationXref
id: HMDB0000208
db: HMDB

Reference/BioCyc CPD-6641
type: UnificationXref
id: CPD-6641
db: BioCyc

Reference/ChemSpider 218
type: UnificationXref
id: 218
db: ChemSpider

2-iminopropanoate
type: SmallMoleculeReference
xref: Reference/ChEBI CHEBI 77456
chemical formula: C3H4NO2
molecular weight: 86.02475
structure: ChemicalStructure/PW C040928

Reference/HMDB HMDB0000574
type: UnificationXref
id: HMDB0000574
db: HMDB

ChemicalStructure/PW C001104
type: ChemicalStructure
structure format: SMILES
structure data: OP(O)(O)=O

Reference/HMDB HMDB0000217
type: UnificationXref
id: HMDB0000217
db: HMDB

ChemicalStructure/PW C000134
type: ChemicalStructure
structure format: SMILES
structure data: OC(=O)CCC(=O)C(O)=O

Oxygen
type: SmallMolecule
entity reference: Oxygen

Reference/ChEBI CHEBI 30915
type: UnificationXref
id: CHEBI:30915
db: ChEBI

Reference/CAS 124-38-9
type: UnificationXref
id: 124-38-9
db: CAS

Hydrogen Ion
type: SmallMolecule
cellular location: Inner Membrane
entity reference: Hydrogen Ion

TransportCatalysis47159
type: Catalysis
controller: Unknown
controlled: Transport66598
control type: ACTIVATION

Reference/BioCyc HSCN
type: UnificationXref
id: HSCN
db: BioCyc

ReactionCoupledTransportCatalysis16930
type: Catalysis
controller: Unknown
controlled: ReactionCoupledTransport16868
control type: ACTIVATION

Reference/HMDB HMDB0001429
type: UnificationXref
id: HMDB0001429
db: HMDB

Reference/HMDB HMDB0003609
type: UnificationXref
id: HMDB0003609
db: HMDB

Reference/ChemSpider 9799
type: UnificationXref
id: 9799
db: ChemSpider

Inner Membrane
type: CellularLocationVocabulary
xref: Reference/GENE ONTOLOGY GO 0070258

Reference/ChEBI CHEBI 15891
type: UnificationXref
id: CHEBI:15891
db: ChEBI

ChemicalStructure/PW C000143
type: ChemicalStructure
structure format: SMILES

Compound/PW C040928/Stoichiometry/1.0
type: Stoichiometry
physical entity: 2-iminopropanoate
stoichiometric coefficient: 1.0

Compound/PW C042929 Inner Membrane/Stoichiometry/1.0
type: Stoichiometry
physical entity: methanesulfonate
stoichiometric coefficient: 1.0

Reference/HMDB HMDB0000221
type: UnificationXref
id: HMDB0000221
db: HMDB

ChemicalStructure/PW C000146
type: ChemicalStructure
structure format: SMILES

Reference/PubChem-compound 6971051
type: UnificationXref
id: 6971051
db: PubChem-compound

Reference/PubChem-compound 159296
type: UnificationXref
id: 159296
db: PubChem-compound

Reference/CAS 7783-06-4
type: UnificationXref
id: 7783-06-4
db: CAS

Flavin Mononucleotide
type: SmallMolecule
entity reference: Flavin Mononucleotide

Flavin Mononucleotide
type: SmallMoleculeReference
xref: Reference/HMDB HMDB0001520
xref: Reference/BioCyc FMN
xref: Reference/ChemSpider 559060
xref: Reference/CAS 146-17-8
xref: Reference/ChEBI CHEBI 17621
xref: Reference/PubChem-compound 643976
xref: Reference/KEGG Compound C00061
chemical formula: C17H21N4O9P
molecular weight: 456.1046
structure: ChemicalStructure/PW C001170

Reference/ChEBI CHEBI 17709
type: UnificationXref
id: CHEBI:17709
db: ChEBI

Reference/CAS 53-57-6
type: UnificationXref
id: 53-57-6
db: CAS

Reference/ChEBI CHEBI 15741
type: UnificationXref
id: CHEBI:15741
db: ChEBI

ChemicalStructure/PW C001316
type: ChemicalStructure
structure format: SMILES
structure data: O=C=O

Reference/ChEBI CHEBI 28938
type: UnificationXref
id: CHEBI:28938
db: ChEBI

Protein/28277/Stoichiometry/2.0
type: Stoichiometry
physical entity: Unknown
stoichiometric coefficient: 2.0

Reference/PubChem-compound 1110
type: UnificationXref
id: 1110
db: PubChem-compound

Taurine
type: SmallMoleculeReference
xref: Reference/CAS 107-35-7
xref: Reference/ChemSpider 1091
xref: Reference/PubChem-compound 1123
xref: Reference/HMDB HMDB0000251
xref: Reference/KEGG Compound C00245
xref: Reference/ChEBI CHEBI 15891
chemical formula: C2H7NO3S
molecular weight: 125.01466
structure: ChemicalStructure/PW C000171

Pyrophosphate
type: SmallMoleculeReference
xref: Reference/PubChem-compound 644102
xref: Reference/BioCyc PPI
xref: Reference/ChemSpider 559142
xref: Reference/ChEBI CHEBI 18361
xref: Reference/HMDB HMDB0000250
xref: Reference/CAS 14000-31-8
xref: Reference/KEGG Compound C00013
chemical formula: H4O7P2
molecular weight: 177.94322
structure: ChemicalStructure/PW C000170

Reference/PubChem-compound 1117
type: UnificationXref
id: 1117
db: PubChem-compound

Compound/PW C000043/Stoichiometry/1.0
type: Stoichiometry
physical entity: Adenosine 3',5'-diphosphate
stoichiometric coefficient: 1.0

Reference/PubChem-compound 5957
type: UnificationXref
id: 5957
db: PubChem-compound

Reference/HMDB HMDB0001448
type: UnificationXref
id: HMDB0001448
db: HMDB

Reference/GENE ONTOLOGY GO 0005620
type: UnificationXref
id: GO:0005620
db: GENE ONTOLOGY

Thiosulfate
type: SmallMoleculeReference
xref: Reference/HMDB HMDB0000257
xref: Reference/PubChem-compound 1084
xref: Reference/KEGG Compound C00320
xref: Reference/ChEBI CHEBI 16094
xref: Reference/CAS 14383-50-7
xref: Reference/BioCyc S2O3
xref: Reference/ChemSpider 1054
chemical formula: H2O3S2
molecular weight: 113.944534
structure: ChemicalStructure/PW C000176

Succinic acid
type: SmallMoleculeReference
xref: Reference/HMDB HMDB0000254
xref: Reference/CAS 110-15-6
xref: Reference/ChEBI CHEBI 15741
xref: Reference/KEGG Compound C00042
xref: Reference/ChemSpider 1078
xref: Reference/PubChem-compound 1110
xref: Reference/BioCyc SUC
chemical formula: C4H6O4
molecular weight: 118.02661
structure: ChemicalStructure/PW C000174

Aminoacetaldehyde
type: SmallMolecule
entity reference: Aminoacetaldehyde

reduced thioredoxin
type: SmallMoleculeReference
xref: Reference/ChEBI CHEBI 15033

Adenosine diphosphate
type: SmallMolecule
entity reference: Adenosine diphosphate

Reference/HMDB HMDB0001453
type: UnificationXref
id: HMDB0001453
db: HMDB

Reference/HMDB HMDB0000243
type: UnificationXref
id: HMDB0000243
db: HMDB

Cyanide
type: SmallMolecule
entity reference: Cyanide

Adenosine diphosphate
type: SmallMoleculeReference
xref: Reference/KEGG Compound C00008
xref: Reference/PubChem-compound 6022
xref: Reference/ChemSpider 5800
xref: Reference/CAS 58-64-0
xref: Reference/BioCyc ADP
xref: Reference/ChEBI CHEBI 16761
xref: Reference/HMDB HMDB0001341
chemical formula: C10H15N5O10P2
molecular weight: 427.02942
structure: ChemicalStructure/PW C001034

Cyanide
type: SmallMoleculeReference
xref: Reference/ChemSpider 5755
xref: Reference/ChEBI CHEBI 17514
xref: Reference/CAS 57-12-5
xref: Reference/KEGG Compound C00177
xref: Reference/HMDB HMDB0002084
xref: Reference/PubChem-compound 5975
chemical formula: CHN
molecular weight: 27.010899
structure: ChemicalStructure/PW C001399

Reference/HMDB HMDB0000240
type: UnificationXref
id: HMDB0000240
db: HMDB

Reference/ChEBI CHEBI 17985
type: UnificationXref
id: CHEBI:17985
db: ChEBI

ChemicalStructure/PW C001938
type: ChemicalStructure
structure format: SMILES
structure data: NC(=C)C(O)=O

Reference/ChEBI CHEBI 17621
type: UnificationXref
id: CHEBI:17621
db: ChEBI

Adenosine triphosphate
type: SmallMolecule
cellular location: Inner Membrane
entity reference: Adenosine triphosphate

Compound/PW C000146/Stoichiometry/3.0
type: Stoichiometry
physical entity: NADPH
stoichiometric coefficient: 3.0

Reference/ChemSpider 1085
type: UnificationXref
id: 1085
db: ChemSpider

Reference/BioCyc CPD-8587
type: UnificationXref
id: CPD-8587
db: BioCyc

Reference/ChEBI CHEBI 17981
type: UnificationXref
id: CHEBI:17981
db: ChEBI

Reference/PubChem-compound 1099
type: UnificationXref
id: 1099
db: PubChem-compound

ChemicalStructure/PW C000967
type: ChemicalStructure
structure format: SMILES
structure data: C[N+](C)(C)CC=O

Reference/ChEBI CHEBI 17980
type: UnificationXref
id: CHEBI:17980
db: ChEBI

Compound/PW C040034/Stoichiometry/5.0
type: Stoichiometry
physical entity: Hydrogen Ion
stoichiometric coefficient: 5.0

oxidized thioredoxin
type: SmallMoleculeReference
xref: Reference/ChEBI CHEBI 15033

Reference/ChemSpider 1091
type: UnificationXref
id: 1091
db: ChemSpider

Compound/PW C000891/Stoichiometry/1.0
type: Stoichiometry
physical entity: FMNH2
stoichiometric coefficient: 1.0

Reference/CAS 14000-31-8
type: UnificationXref
id: 14000-31-8
db: CAS

Phosphate
type: SmallMolecule
cellular location: Inner Membrane
entity reference: Phosphate

Reference/PubChem-compound 1084
type: UnificationXref
id: 1084
db: PubChem-compound

Reference/ChEBI CHEBI 17514
type: UnificationXref
id: CHEBI:17514
db: ChEBI

Compound/PW C000414 Inner Membrane/Stoichiometry/1.0
type: Stoichiometry
physical entity: Adenosine triphosphate
stoichiometric coefficient: 1.0

Reference/ChemSpider 5675
type: UnificationXref
id: 5675
db: ChemSpider

ChemicalStructure/PW C001827
type: ChemicalStructure
structure format: SMILES
structure data: S

Reference/ChemSpider 1078
type: UnificationXref
id: 1078
db: ChemSpider

Reference/CAS 14798-03-9
type: UnificationXref
id: 14798-03-9
db: CAS

Reference/ChEBI CHEBI 17628
type: UnificationXref
id: CHEBI:17628
db: ChEBI

Compound/PW C000171 Cytosol/Stoichiometry/1.0
type: Stoichiometry
physical entity: Taurine
stoichiometric coefficient: 1.0

Water
type: SmallMolecule
cellular location: Inner Membrane
entity reference: Water

Reference/BioCyc NH42SO4
type: UnificationXref
id: NH42SO4
db: BioCyc

Reference/ChEBI CHEBI 15422
type: UnificationXref
id: CHEBI:15422
db: ChEBI

Reference/PubChem-compound 643976
type: UnificationXref
id: 643976
db: PubChem-compound

Reference/KEGG Compound C00979
type: UnificationXref
id: C00979
db: KEGG Compound

3-mercaptopyruvate sulfurtransferase
type: ProteinReference
xref: Reference/UniProt P31142

Reference/ChemSpider 9821
type: UnificationXref
id: 9821
db: ChemSpider

Protein/28277/Stoichiometry/4.0
type: Stoichiometry
physical entity: Unknown
stoichiometric coefficient: 4.0

Oxygen
type: SmallMoleculeReference
xref: Reference/HMDB HMDB0001377
xref: Reference/ChemSpider 952
xref: Reference/KEGG Compound C00007
xref: Reference/ChEBI CHEBI 15379
xref: Reference/PubChem-compound 977
xref: Reference/BioCyc CPD-6641
xref: Reference/CAS 7782-44-7
chemical formula: O2
molecular weight: 31.98983
structure: ChemicalStructure/PW C001065

Reference/CAS 127-17-3
type: UnificationXref
id: 127-17-3
db: CAS

Compound/PW C001316/Stoichiometry/1.0
type: Stoichiometry
physical entity: Carbon dioxide
stoichiometric coefficient: 1.0

Transport66598
type: Transport
participant stoichiometry: Compound/PW C000171 Periplasmic Space/Stoichiometry/1.0
participant stoichiometry: Compound/PW C000171 Cytosol/Stoichiometry/1.0
right: Taurine
spontaneous: false
left: Taurine
name: Taurine (→) Transport: Escherichia coli O111:H- str. 11128, Periplasmic Space to Escherichia coli O111:H- str. 11128, Cytosol
conversion direction: LEFT_TO_RIGHT

Compound/PW C000162/Stoichiometry/1.0
type: Stoichiometry
physical entity: Sulfite
stoichiometric coefficient: 1.0

ChemicalStructure/PW C022608
type: ChemicalStructure
structure format: SMILES
structure data: [NH4+]

Reference/CAS 107-35-7
type: UnificationXref
id: 107-35-7
db: CAS

Reference/ChEBI CHEBI 16526
type: UnificationXref
id: CHEBI:16526
db: ChEBI

Reference/SMPDB SMP0441037
type: UnificationXref
id: SMP0441037
db: SMPDB

Reference/ChemSpider 8961
type: UnificationXref
id: 8961
db: ChemSpider

Compound/PW C000134/Stoichiometry/1.0
type: Stoichiometry
physical entity: Oxoglutaric acid
stoichiometric coefficient: 1.0

Reference/ChEBI CHEBI 16761
type: UnificationXref
id: CHEBI:16761
db: ChEBI

Reference/CAS 7782-44-7
type: UnificationXref
id: 7782-44-7
db: CAS

cystathionine-β-lyase / L-cysteine desulfhydrase
type: Complex
component stoichiometry: Protein/28277/Stoichiometry/4.0
component: Unknown

bifunctional β-cystathionase, PLP-dependent and regulator of maltose regulon
type: Complex
component stoichiometry: Protein/28277/Stoichiometry/2.0
component: Unknown

Compound/PW C001827/Stoichiometry/1.0
type: Stoichiometry
physical entity: Hydrogen sulfide
stoichiometric coefficient: 1.0

Reference/UniProt P31142
type: UnificationXref
id: P31142
db: UniProt

Reference/ChEBI CHEBI 25224
type: UnificationXref
id: CHEBI:25224
db: ChEBI

Reference/ChEBI CHEBI 15366
type: UnificationXref
id: CHEBI:15366
db: ChEBI

Reference/BioCyc 2-KETOGLUTARATE
type: UnificationXref
id: 2-KETOGLUTARATE
db: BioCyc

Reference/KEGG Compound C01847
type: UnificationXref
id: C01847
db: KEGG Compound

Compound/PW C000174/Stoichiometry/1.0
type: Stoichiometry
physical entity: Succinic acid
stoichiometric coefficient: 1.0

ChemicalStructure/PW C000886
type: ChemicalStructure
structure format: SMILES

Compound/PW C001104/Stoichiometry/1.0
type: Stoichiometry
physical entity: Phosphate
stoichiometric coefficient: 1.0

Reference/BioCyc PAPS
type: UnificationXref
id: PAPS
db: BioCyc

ChemicalStructure/PW C000891
type: ChemicalStructure
structure format: SMILES

Reference/CAS 110-15-6
type: UnificationXref
id: 110-15-6
db: CAS

Reference/ChemSpider 171
type: UnificationXref
id: 171
db: ChemSpider

Reference/ChEBI CHEBI 32816
type: UnificationXref
id: CHEBI:32816
db: ChEBI

ReactionCoupledTransport20285
type: TransportWithBiochemicalReaction
participant stoichiometry: Compound/PW C042929 Inner Membrane/Stoichiometry/1.0
participant stoichiometry: Compound/PW C040034 Inner Membrane/Stoichiometry/1.0
participant stoichiometry: Compound/PW C000414 Inner Membrane/Stoichiometry/1.0
participant stoichiometry: Compound/PW C001420 Inner Membrane/Stoichiometry/1.0
participant stoichiometry: Compound/PW C001034 Inner Membrane/Stoichiometry/1.0
participant stoichiometry: Compound/PW C001104 Inner Membrane/Stoichiometry/1.0
right: Phosphate
right: methanesulfonate
right: Adenosine diphosphate
right: Hydrogen Ion
spontaneous: false
left: Water
left: methanesulfonate
left: Adenosine triphosphate
name: Adenosine triphosphate + Water + methanesulfonate → Adenosine diphosphate + Hydrogen Ion + Phosphate + methanesulfonate
conversion direction: LEFT_TO_RIGHT

Reference/ChEBI CHEBI 15377
type: UnificationXref
id: CHEBI:15377
db: ChEBI

Reference/ChEBI CHEBI 15379
type: UnificationXref
id: CHEBI:15379
db: ChEBI

Reference/ChEBI CHEBI 15378
type: UnificationXref
id: CHEBI:15378
db: ChEBI

ChemicalStructure/PW C040034
type: ChemicalStructure
structure format: SMILES
structure data: [H+]

ChemicalStructure/PW C000414
type: ChemicalStructure
structure format: SMILES

Reference/PubChem-compound 5886
type: UnificationXref
id: 5886
db: PubChem-compound

Compound/PW C022608/Stoichiometry/1.0
type: Stoichiometry
physical entity: Ammonium
stoichiometric coefficient: 1.0

Compound/PW C001420/Stoichiometry/1.0
type: Stoichiometry
physical entity: Water
stoichiometric coefficient: 1.0

Reference/PubChem-compound 280
type: UnificationXref
id: 280
db: PubChem-compound

methanesulfonate
type: SmallMolecule
cellular location: Inner Membrane
entity reference: methanesulfonate

Reference/PubChem-compound 16741146
type: UnificationXref
id: 16741146
db: PubChem-compound

ReactionCatalysis1053367
type: Catalysis
controller: alkanesulfonate monooxygenase, FMNH2-dependent
controlled: 1.14.14.5
control type: ACTIVATION

Compound/PW C001170/Stoichiometry/1.0
type: Stoichiometry
physical entity: Flavin Mononucleotide
stoichiometric coefficient: 1.0

ReactionCatalysis734409
type: Catalysis
controller: adenylylsulfate kinase
controlled: 2.7.1.25
control type: ACTIVATION

Compound/PW C000171 Periplasmic Space/Stoichiometry/1.0
type: Stoichiometry
physical entity: Taurine
stoichiometric coefficient: 1.0

Compound/PW C001938/Stoichiometry/1.0
type: Stoichiometry
physical entity: 2-Aminoacrylic acid
stoichiometric coefficient: 1.0

Reference/BioCyc HS
type: UnificationXref
id: HS
db: BioCyc

Reference/BioCyc FMNH2
type: UnificationXref
id: FMNH2
db: BioCyc

ReactionCatalysis1053252
type: Catalysis
controller: sulfite reductase
controlled: 1.8.1.2
control type: ACTIVATION

ReactionCatalysis1053251
type: Catalysis
controller: thiosulfate sulfurtransferase
controlled: 2.8.1.1
control type: ACTIVATION

ReactionCatalysis1053254
type: Catalysis
controller: cysteine synthase B
controlled: 2.5.1.47
control type: ACTIVATION

ReactionCatalysis1053253
type: Catalysis
controller: O-acetylserine sulfhydrylase A
controlled: 2.5.1.47
control type: ACTIVATION

ReactionCatalysis734410
type: Catalysis
controller: sulfate adenylyltransferase
controlled: 2.7.7.4
control type: ACTIVATION

Reference/PubChem-compound 1060
type: UnificationXref
id: 1060
db: PubChem-compound

ReactionCatalysis1053259
type: Catalysis
controller: O-acetylserine sulfhydrylase A
controlled: Reaction1033291
control type: ACTIVATION

Reference/PubChem-compound 1061
type: UnificationXref
id: 1061
db: PubChem-compound

Reference/KEGG Compound C01755
type: UnificationXref
id: C01755
db: KEGG Compound

ReactionCatalysis1053256
type: Catalysis
controller: tryptophanase / L-cysteine desulfhydrase
controlled: Reaction1033291
control type: ACTIVATION

ReactionCatalysis1053258
type: Catalysis
controller: cysteine synthase B
controlled: Reaction1033291
control type: ACTIVATION

ReactionCatalysis1053257
type: Catalysis
controller: bifunctional β-cystathionase, PLP-dependent and regulator of maltose regulon
controlled: Reaction1033291
control type: ACTIVATION

Reference/HMDB HMDB0001967
type: UnificationXref
id: HMDB0001967
db: HMDB

Reference/CAS 14383-50-7
type: UnificationXref
id: 14383-50-7
db: CAS

Compound/PW C001420 Inner Membrane/Stoichiometry/1.0
type: Stoichiometry
physical entity: Water
stoichiometric coefficient: 1.0

Reference/PubChem-compound 176
type: UnificationXref
id: 176
db: PubChem-compound

ReactionCatalysis1053262
type: Catalysis
controller: Unknown
controlled: 3.1.3.7
control type: ACTIVATION

ReactionCatalysis1053265
type: Catalysis
controller: 3'-phospho-adenylylsulfate reductase
controlled: 1.8.4.8
control type: ACTIVATION

ReactionCatalysis1053264
type: Catalysis
controller: Unknown
controlled: 1.14.11.17
control type: ACTIVATION

Compound/PW C000886/Stoichiometry/1.0
type: Stoichiometry
physical entity: Phosphoadenosine phosphosulfate
stoichiometric coefficient: 1.0

ReactionCatalysis1053260
type: Catalysis
controller: cystathionine-β-lyase / L-cysteine desulfhydrase
controlled: Reaction1033291
control type: ACTIVATION