Reference/ChEBI CHEBI 16015
type: UnificationXref
id: CHEBI:16015
db: ChEBI

ReactionCatalysis6451
type: Catalysis
controller: Tryptophan synthase
controlled: Reaction6532
control type: ACTIVATION

Reference/PubChem-compound 6140
type: UnificationXref
id: 6140
db: PubChem-compound

ReactionCatalysis6450
type: Catalysis
controller: Tryptophan synthase
controlled: 4.2.1.20
control type: ACTIVATION

Reference/PubChem-compound 800
type: UnificationXref
id: 800
db: PubChem-compound

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

Reference/HMDB HMDB0012199
type: UnificationXref
id: HMDB0012199
db: HMDB

Reference/CAS 63-91-2
type: UnificationXref
id: 63-91-2
db: CAS

Reference/UniProt P00912
type: UnificationXref
id: P00912
db: UniProt

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

Compound/PW C000935/Stoichiometry/1.0
type: Stoichiometry
physical entity: N'-Formylkynurenine
stoichiometric coefficient: 1.0

Reference/PubChem-compound 439153
type: UnificationXref
id: 439153
db: PubChem-compound

Reference/CAS 16597-58-3
type: UnificationXref
id: 16597-58-3
db: CAS

ReactionCatalysis6455
type: Catalysis
controller: aromatic amino acid aminotransferase II
controlled: Reaction6536
control type: ACTIVATION

ReactionCatalysis6454
type: Catalysis
controller: Aromatic/aminoadipate aminotransferase 1
controlled: Reaction6535
control type: ACTIVATION

ReactionCatalysis6453
type: Catalysis
controller: Kynureninase
controlled: Reaction6534
control type: ACTIVATION

ReactionCatalysis6452
type: Catalysis
controller: Indoleamine 2,3-dioxygenase
controlled: Reaction6533
control type: ACTIVATION

Reference/UniProt P38169
type: UnificationXref
id: P38169
db: UniProt

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

ReactionCatalysis6457
type: Catalysis
controller: alcohol dehydrogenase
controlled: Reaction6538
control type: ACTIVATION

ReactionCatalysis6456
type: Catalysis
controller: pyruvate decarboxylase
controlled: Reaction6537
control type: ACTIVATION

Reference/KEGG Compound C00328
type: UnificationXref
id: C00328
db: KEGG Compound

Reference/ChEBI CHEBI 17115
type: UnificationXref
id: CHEBI:17115
db: ChEBI

Reference/PubChem-compound 910
type: UnificationXref
id: 910
db: PubChem-compound

Reference/HMDB HMDB0001190
type: UnificationXref
id: HMDB0001190
db: HMDB

NAD
type: SmallMolecule
entity reference: NAD

Reference/ChEBI CHEBI 17111
type: UnificationXref
id: CHEBI:17111
db: ChEBI

Compound/PW C000095/Stoichiometry/1.0
type: Stoichiometry
physical entity: L-Glutamic acid
stoichiometric coefficient: 1.0

2-Oxo-3-phenylpropanoic acid (Mixture oxo and keto)
type: SmallMoleculeReference
xref: Reference/CAS 156-06-9
xref: Reference/HMDB HMDB0031629
xref: Reference/ChEBI CHEBI 30851
xref: Reference/ChemSpider 972
xref: Reference/PubChem-compound 997
xref: Reference/KEGG Compound C00166
chemical formula: C9H8O3
molecular weight: 164.04735
structure: ChemicalStructure/PW C012810

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

Reference/ChemSpider 5746
type: UnificationXref
id: 5746
db: ChemSpider

Indoleacetaldehyde
type: SmallMoleculeReference
xref: Reference/HMDB HMDB0001190
xref: Reference/KEGG Compound C00637
xref: Reference/PubChem-compound 800
xref: Reference/CAS 2591-98-2
xref: Reference/ChEBI CHEBI 18086
xref: Reference/ChemSpider 778
xref: Reference/BioCyc INDOLE ACETALDEHYDE
chemical formula: C10H9NO
molecular weight: 159.06842
structure: ChemicalStructure/PW C000926

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

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

ChemicalStructure/PW C007748
type: ChemicalStructure
structure format: SMILES

Reference/UniProt P00937
type: UnificationXref
id: P00937
db: UniProt

Reference/CAS 7540-64-9
type: UnificationXref
id: 7540-64-9
db: CAS

Reference/ChEBI CHEBI 995
type: UnificationXref
id: CHEBI:995
db: ChEBI

ChemicalStructure/PW C042673
type: ChemicalStructure
structure format: SMILES

Reference/UniProt P00931
type: UnificationXref
id: P00931
db: UniProt

Reference/KEGG Compound C00108
type: UnificationXref
id: C00108
db: KEGG Compound

N'-Formylkynurenine
type: SmallMoleculeReference
xref: Reference/ChemSpider 886
xref: Reference/HMDB HMDB0001200
xref: Reference/KEGG Compound C02406
xref: Reference/PubChem-compound 910
xref: Reference/ChEBI CHEBI 18377
xref: Reference/BioCyc N-FORMYLKYNURENINE
xref: Reference/CAS 1022-31-7
chemical formula: C11H12N2O4
molecular weight: 236.07971
structure: ChemicalStructure/PW C000935

Reference/ChemSpider 5736
type: UnificationXref
id: 5736
db: ChemSpider

Compound/PW C000104/Stoichiometry/1.0
type: Stoichiometry
physical entity: L-Phenylalanine
stoichiometric coefficient: 1.0

indole-3-pyruvate
type: SmallMolecule
entity reference: indole-3-pyruvate

Indoleglycerol phosphate
type: SmallMolecule
entity reference: Indoleglycerol phosphate

Reference/ChemSpider 709
type: UnificationXref
id: 709
db: ChemSpider

Reference/KEGG Compound C02406
type: UnificationXref
id: C02406
db: KEGG Compound

Reference/ChemSpider 5735
type: UnificationXref
id: 5735
db: ChemSpider

Tryptophol
type: SmallMolecule
entity reference: Tryptophol

Reference/KEGG Compound C00463
type: UnificationXref
id: C00463
db: KEGG Compound

Reference/ChEBI CHEBI 17333
type: UnificationXref
id: CHEBI:17333
db: ChEBI

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

Saccharomyces cerevisiae
type: BioSource
xref: Reference/TAXONOMY 4932

Reference/CAS 73-22-3
type: UnificationXref
id: 73-22-3
db: CAS

Compound/PW C000092/Stoichiometry/1.0
type: Stoichiometry
physical entity: Formic acid
stoichiometric coefficient: 1.0

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

3-hydroxy-L-kynurenine
type: SmallMoleculeReference
xref: Reference/PubChem-compound 49791998
chemical formula: C10H12N2O4
molecular weight: 224.07971
structure: ChemicalStructure/PW C044560

3-hydroxy-L-kynurenine
type: SmallMolecule
entity reference: 3-hydroxy-L-kynurenine

Indoleglycerol phosphate
type: SmallMoleculeReference
xref: Reference/PubChem-compound 46878464
chemical formula: C11H12NO6P
molecular weight: 285.04022
structure: ChemicalStructure/PW C044564

Reference/KEGG Compound C00119
type: UnificationXref
id: C00119
db: KEGG Compound

D-Glyceraldehyde 3-phosphate
type: SmallMoleculeReference
xref: Reference/BioCyc GAP
xref: Reference/ChEBI CHEBI 17138
xref: Reference/HMDB HMDB0001112
xref: Reference/ChemSpider 709
xref: Reference/KEGG Compound C00661
xref: Reference/PubChem-compound 729
xref: Reference/CAS 591-59-3
chemical formula: C3H7O6P
molecular weight: 169.99803
structure: ChemicalStructure/PW C000869

Aromatic/aminoadipate aminotransferase 1
type: ProteinReference
xref: Reference/UniProt P53090

Compound/PW C000146/Stoichiometry/1.0
type: Stoichiometry
physical entity: NADPH
stoichiometric coefficient: 1.0

pyruvate decarboxylase 2
type: ProteinReference
xref: Reference/UniProt P16467

alcohol dehydrogenase subunit I
type: ProteinReference
xref: Reference/UniProt P25377

Pyruvate decarboxylase isozyme 1
type: ProteinReference
xref: Reference/UniProt P06169

ChemicalStructure/PW C000926
type: ChemicalStructure
structure format: SMILES
structure data: O=CCC1=CNC2=C1C=CC=C2

L-Glutamine
type: SmallMoleculeReference
xref: Reference/HMDB HMDB0000641
xref: Reference/ChEBI CHEBI 18050
xref: Reference/ChemSpider 5746
xref: Reference/BioCyc GLN
xref: Reference/KEGG Compound C00064
xref: Reference/PubChem-compound 5961
xref: Reference/CAS 56-85-9
chemical formula: C5H10N2O3
molecular weight: 146.06914
structure: ChemicalStructure/PW C000500

Hydrogen Ion
type: SmallMolecule
entity reference: Hydrogen Ion

Compound/PW C000741/Stoichiometry/1.0
type: Stoichiometry
physical entity: L-Tryptophan
stoichiometric coefficient: 1.0

L-Tryptophan
type: SmallMoleculeReference
xref: Reference/CAS 73-22-3
xref: Reference/KEGG Compound C00078
xref: Reference/ChEBI CHEBI 16828
xref: Reference/PubChem-compound 6305
xref: Reference/BioCyc TRP
xref: Reference/HMDB HMDB0000929
xref: Reference/ChemSpider 6066
chemical formula: C11H12N2O2
molecular weight: 204.08987
structure: ChemicalStructure/PW C000741

L-Kynurenine
type: SmallMolecule
entity reference: L-Kynurenine

Reference/UniProt P26263
type: UnificationXref
id: P26263
db: UniProt

Reference/HMDB HMDB0031629
type: UnificationXref
id: HMDB0031629
db: HMDB

Pyruvate decarboxylase isozyme 3
type: ProteinReference
xref: Reference/UniProt P26263

alcohol dehydrogenase subunit 2
type: ProteinReference
xref: Reference/UniProt Q04894

Multifunctional tryptophan biosynthesis protein
type: ProteinReference
xref: Reference/UniProt P00937

Anthranilate synthase component 1
type: ProteinReference
xref: Reference/UniProt P00899

1-(2-carboxyphenylamino)-1-deoxy-D-ribulose 5-phosphate
type: SmallMoleculeReference
chemical formula: C12H16NO9P
molecular weight: 349.05627
structure: ChemicalStructure/PW C042673

N-(5'-phosphoribosyl)anthranilate isomerase
type: ProteinReference
xref: Reference/UniProt P00912

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

2-Aminobenzoic acid
type: SmallMoleculeReference
xref: Reference/KEGG Compound C00108
xref: Reference/ChEBI CHEBI 30754
xref: Reference/HMDB HMDB0001123
xref: Reference/ChemSpider 222
xref: Reference/CAS 118-92-3
xref: Reference/PubChem-compound 227
xref: Reference/BioCyc ANTHRANILATE
chemical formula: C7H7NO2
molecular weight: 137.04768
structure: ChemicalStructure/PW C000877

Anthranilate phosphoribosyltransferase
type: ProteinReference
xref: Reference/UniProt P07285

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

Compound/PW C000500/Stoichiometry/1.0
type: Stoichiometry
physical entity: L-Glutamine
stoichiometric coefficient: 1.0

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

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

Reference/BioCyc L-ALPHA-ALANINE
type: UnificationXref
id: L-ALPHA-ALANINE
db: BioCyc

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

Reference/CAS 56-41-7
type: UnificationXref
id: 56-41-7
db: CAS

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

Reference/UniProt P47096
type: UnificationXref
id: P47096
db: UniProt

ChemicalStructure/PW C000935
type: ChemicalStructure
structure format: SMILES
structure data: NC(CC(=O)C1=CC=CC=C1NC=O)C(O)=O

Reference/KEGG Compound C00004
type: UnificationXref
id: C00004
db: KEGG Compound

Compound/PW C012810/Stoichiometry/1.0
type: Stoichiometry
physical entity: 2-Oxo-3-phenylpropanoic acid (Mixture oxo and keto)
stoichiometric coefficient: 1.0

Reference/KEGG Compound C00003
type: UnificationXref
id: C00003
db: KEGG Compound

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

Reference/UniProt P16467
type: UnificationXref
id: P16467
db: UniProt

Compound/PW C000190/Stoichiometry/1.0
type: Stoichiometry
physical entity: Phosphoribosyl pyrophosphate
stoichiometric coefficient: 1.0

2-Oxo-3-phenylpropanoic acid (Mixture oxo and keto)
type: SmallMolecule
entity reference: 2-Oxo-3-phenylpropanoic acid (Mixture oxo and keto)

Reference/ChemSpider 84
type: UnificationXref
id: 84
db: ChemSpider

Tryptophan synthase
type: ProteinReference
xref: Reference/UniProt P00931

NAD
type: SmallMoleculeReference
xref: Reference/ChEBI CHEBI 15846
xref: Reference/HMDB HMDB0000902
xref: Reference/CAS 53-84-9
xref: Reference/KEGG Compound C00003
xref: Reference/PubChem-compound 5893
xref: Reference/BioCyc NAD
xref: Reference/ChemSpider 5682
chemical formula: C21H27N7O14P2
molecular weight: 663.10913
structure: ChemicalStructure/PW C000721

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

Reference/PubChem-compound 7339
type: UnificationXref
id: 7339
db: PubChem-compound

Reference/KEGG Compound C00251
type: UnificationXref
id: C00251
db: KEGG Compound

Reference/HMDB HMDB0000902
type: UnificationXref
id: HMDB0000902
db: HMDB

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

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

4.1.3.27
type: BiochemicalReaction
participant stoichiometry: Compound/PW C000095/Stoichiometry/1.0
participant stoichiometry: Compound/PW C007748/Stoichiometry/1.0
participant stoichiometry: Compound/PW C000500/Stoichiometry/1.0
participant stoichiometry: Compound/PW C000877/Stoichiometry/1.0
participant stoichiometry: Compound/PW C000164/Stoichiometry/1.0
participant stoichiometry: Compound/PW C040034/Stoichiometry/1.0
right: L-Glutamic acid
right: Hydrogen Ion
right: Pyruvic acid
right: 2-Aminobenzoic acid
spontaneous: false
EC number: 4.1.3.27
left: L-Glutamine
left: Chorismate
name: Chorismate + L-Glutamine → 2-Aminobenzoic acid + Hydrogen Ion + L-Glutamic acid + Pyruvic acid
conversion direction: LEFT_TO_RIGHT

2.4.2.18
type: BiochemicalReaction
participant stoichiometry: Compound/PW C000170/Stoichiometry/1.0
participant stoichiometry: Compound/PW C000877/Stoichiometry/1.0
participant stoichiometry: Compound/PW C000190/Stoichiometry/1.0
participant stoichiometry: Compound/PW C040925/Stoichiometry/1.0
right: N-(5-phosphoribosyl)-anthranilate
right: Pyrophosphate
spontaneous: false
EC number: 2.4.2.18
left: 2-Aminobenzoic acid
left: Phosphoribosyl pyrophosphate
name: 2-Aminobenzoic acid + Phosphoribosyl pyrophosphate → N-(5-phosphoribosyl)-anthranilate + Pyrophosphate
conversion direction: LEFT_TO_RIGHT

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

5.3.1.24
type: BiochemicalReaction
participant stoichiometry: Compound/PW C042673/Stoichiometry/1.0
participant stoichiometry: Compound/PW C040925/Stoichiometry/1.0
right: 1-(2-carboxyphenylamino)-1-deoxy-D-ribulose 5-phosphate
spontaneous: false
EC number: 5.3.1.24
left: N-(5-phosphoribosyl)-anthranilate
name: N-(5-phosphoribosyl)-anthranilate → 1-(2-carboxyphenylamino)-1-deoxy-D-ribulose 5-phosphate
conversion direction: LEFT_TO_RIGHT

Reference/ChEBI CHEBI 17138
type: UnificationXref
id: CHEBI:17138
db: ChEBI

aromatic amino acid aminotransferase II
type: ProteinReference
xref: Reference/UniProt P38840

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

D-Glyceraldehyde 3-phosphate
type: SmallMolecule
entity reference: D-Glyceraldehyde 3-phosphate

L-Glutamine
type: SmallMolecule
entity reference: L-Glutamine

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

L-Tryptophan
type: SmallMolecule
entity reference: L-Tryptophan

Reference/CAS 53-84-9
type: UnificationXref
id: 53-84-9
db: CAS

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

Reference/KEGG Compound C00025
type: UnificationXref
id: C00025
db: KEGG Compound

ReactionCatalysis6449
type: Catalysis
controller: N-(5'-phosphoribosyl)anthranilate isomerase
controlled: 5.3.1.24
control type: ACTIVATION

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

ReactionCatalysis6448
type: Catalysis
controller: Anthranilate phosphoribosyltransferase
controlled: 2.4.2.18
control type: ACTIVATION

ReactionCatalysis6447
type: Catalysis
controller: Anthranilate synthase component
controlled: 4.1.3.27
control type: ACTIVATION

Reference/CAS 1022-31-7
type: UnificationXref
id: 1022-31-7
db: CAS

Reference/UniProt P25377
type: UnificationXref
id: P25377
db: UniProt

Reference/ChemSpider 778
type: UnificationXref
id: 778
db: ChemSpider

Reference/ChEBI CHEBI 18277
type: UnificationXref
id: CHEBI:18277
db: ChEBI

Reference/ChemSpider 776
type: UnificationXref
id: 776
db: ChemSpider

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

ChemicalStructure/PW C001144
type: ChemicalStructure
structure format: SMILES

Water
type: SmallMolecule
entity reference: Water

Reference/KEGG Compound C00041
type: UnificationXref
id: C00041
db: KEGG Compound

ChemicalStructure/PW C001026
type: ChemicalStructure
structure format: SMILES
structure data: N\C(C(O)=O)=C(\C=C/C=O)/C(O)=O

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

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

Reference/KEGG Compound C04409
type: UnificationXref
id: C04409
db: KEGG Compound

Reference/PubChem-compound 997
type: UnificationXref
id: 997
db: PubChem-compound

Reference/KEGG Compound C00166
type: UnificationXref
id: C00166
db: KEGG Compound

Reference/CAS 56-85-9
type: UnificationXref
id: 56-85-9
db: CAS

Reference/ChemSpider 886
type: UnificationXref
id: 886
db: ChemSpider

Reference/HMDB HMDB0001476
type: UnificationXref
id: HMDB0001476
db: HMDB

Reaction6535
type: BiochemicalReaction
participant stoichiometry: Compound/PW C000095/Stoichiometry/1.0
participant stoichiometry: Compound/PW C000741/Stoichiometry/1.0
participant stoichiometry: Compound/PW C000134/Stoichiometry/1.0
participant stoichiometry: Compound/PW C044565/Stoichiometry/1.0
right: L-Glutamic acid
right: indole-3-pyruvate
spontaneous: false
left: Oxoglutaric acid
left: L-Tryptophan
name: L-Tryptophan + Oxoglutaric acid → L-Glutamic acid + indole-3-pyruvate
conversion direction: LEFT_TO_RIGHT

Compound/PW C044564/Stoichiometry/1.0
type: Stoichiometry
physical entity: Indoleglycerol phosphate
stoichiometric coefficient: 1.0

Reference/HMDB HMDB0001112
type: UnificationXref
id: HMDB0001112
db: HMDB

Reaction6536
type: BiochemicalReaction
participant stoichiometry: Compound/PW C000104/Stoichiometry/1.0
participant stoichiometry: Compound/PW C000741/Stoichiometry/1.0
participant stoichiometry: Compound/PW C044565/Stoichiometry/1.0
participant stoichiometry: Compound/PW C012810/Stoichiometry/1.0
right: indole-3-pyruvate
right: L-Phenylalanine
spontaneous: false
left: 2-Oxo-3-phenylpropanoic acid (Mixture oxo and keto)
left: L-Tryptophan
name: 2-Oxo-3-phenylpropanoic acid (Mixture oxo and keto) + L-Tryptophan → L-Phenylalanine + indole-3-pyruvate
conversion direction: LEFT_TO_RIGHT

Reference/ChemSpider 7062
type: UnificationXref
id: 7062
db: ChemSpider

Reaction6537
type: BiochemicalReaction
participant stoichiometry: Compound/PW C001316/Stoichiometry/1.0
participant stoichiometry: Compound/PW C000926/Stoichiometry/1.0
participant stoichiometry: Compound/PW C044565/Stoichiometry/1.0
participant stoichiometry: Compound/PW C040034/Stoichiometry/1.0
right: Indoleacetaldehyde
right: Carbon dioxide
spontaneous: false
left: indole-3-pyruvate
left: Hydrogen Ion
name: Hydrogen Ion + indole-3-pyruvate → Carbon dioxide + Indoleacetaldehyde
conversion direction: LEFT_TO_RIGHT

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

Reaction6538
type: BiochemicalReaction
participant stoichiometry: Compound/PW C000721/Stoichiometry/1.0
participant stoichiometry: Compound/PW C000926/Stoichiometry/1.0
participant stoichiometry: Compound/PW C001144/Stoichiometry/1.0
participant stoichiometry: Compound/PW C044566/Stoichiometry/1.0
participant stoichiometry: Compound/PW C040034/Stoichiometry/1.0
right: Tryptophol
right: NAD
spontaneous: false
left: Indoleacetaldehyde
left: NADH
left: Hydrogen Ion
name: Hydrogen Ion + Indoleacetaldehyde + NADH → NAD + Tryptophol
conversion direction: LEFT_TO_RIGHT

Reference/HMDB HMDB0000148
type: UnificationXref
id: HMDB0000148
db: HMDB

Reference/BioCyc 2-AMINO-3-CARBOXYMUCONATE SEMIAL
type: UnificationXref
id: 2-AMINO-3-CARBOXYMUCONATE_SEMIAL
db: BioCyc

Reaction6530
type: BiochemicalReaction
participant stoichiometry: Compound/PW C044564/Stoichiometry/1.0
participant stoichiometry: Compound/PW C001420/Stoichiometry/1.0
participant stoichiometry: Compound/PW C001316/Stoichiometry/1.0
participant stoichiometry: Compound/PW C042673/Stoichiometry/1.0
participant stoichiometry: Compound/PW C040034/Stoichiometry/1.0
right: Water
right: Indoleglycerol phosphate
right: Carbon dioxide
spontaneous: false
left: 1-(2-carboxyphenylamino)-1-deoxy-D-ribulose 5-phosphate
left: Hydrogen Ion
name: 1-(2-carboxyphenylamino)-1-deoxy-D-ribulose 5-phosphate + Hydrogen Ion → Carbon dioxide + Indoleglycerol phosphate + Water
conversion direction: LEFT_TO_RIGHT

4.2.1.20
type: BiochemicalReaction
participant stoichiometry: Compound/PW C044564/Stoichiometry/1.0
participant stoichiometry: Compound/PW C000587/Stoichiometry/1.0
participant stoichiometry: Compound/PW C000869/Stoichiometry/1.0
right: D-Glyceraldehyde 3-phosphate
right: Indole
spontaneous: false
EC number: 4.2.1.20
left: Indoleglycerol phosphate
name: Indoleglycerol phosphate → D-Glyceraldehyde 3-phosphate + Indole
conversion direction: LEFT_TO_RIGHT

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

Reaction6532
type: BiochemicalReaction
participant stoichiometry: Compound/PW C001420/Stoichiometry/1.0
participant stoichiometry: Compound/PW C000741/Stoichiometry/1.0
participant stoichiometry: Compound/PW C000587/Stoichiometry/1.0
participant stoichiometry: Compound/PW C000120/Stoichiometry/1.0
right: Water
right: L-Tryptophan
spontaneous: false
left: L-Serine
left: Indole
name: Indole + L-Serine → L-Tryptophan + Water
conversion direction: LEFT_TO_RIGHT

Reaction6533
type: BiochemicalReaction
participant stoichiometry: Compound/PW C001065/Stoichiometry/1.0
participant stoichiometry: Compound/PW C000935/Stoichiometry/1.0
participant stoichiometry: Compound/PW C000741/Stoichiometry/1.0
right: N'-Formylkynurenine
right: Oxygen
spontaneous: false
left: L-Tryptophan
name: L-Tryptophan → N'-Formylkynurenine + Oxygen
conversion direction: LEFT_TO_RIGHT

Reference/HMDB HMDB0000142
type: UnificationXref
id: HMDB0000142
db: HMDB

Reaction6534
type: BiochemicalReaction
participant stoichiometry: Compound/PW C001420/Stoichiometry/1.0
participant stoichiometry: Compound/PW C000538/Stoichiometry/1.0
participant stoichiometry: Compound/PW C000105/Stoichiometry/1.0
participant stoichiometry: Compound/PW C000877/Stoichiometry/1.0
participant stoichiometry: Compound/PW C040034/Stoichiometry/1.0
right: Hydrogen Ion
right: L-Alanine
right: 2-Aminobenzoic acid
spontaneous: false
left: Water
left: L-Kynurenine
name: L-Kynurenine + Water → 2-Aminobenzoic acid + Hydrogen Ion + L-Alanine
conversion direction: LEFT_TO_RIGHT

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

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

Reference/ChEBI CHEBI 18377
type: UnificationXref
id: CHEBI:18377
db: ChEBI

Reference/KEGG Compound C00058
type: UnificationXref
id: C00058
db: KEGG Compound

Reference/CAS 591-59-3
type: UnificationXref
id: 591-59-3
db: CAS

Reference/HMDB HMDB0001487
type: UnificationXref
id: HMDB0001487
db: HMDB

Reference/HMDB HMDB0001123
type: UnificationXref
id: HMDB0001123
db: HMDB

Reference/HMDB HMDB0000159
type: UnificationXref
id: HMDB0000159
db: HMDB

Reference/CAS 56-86-0
type: UnificationXref
id: 56-86-0
db: CAS

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

Reference/CAS 156-06-9
type: UnificationXref
id: 156-06-9
db: CAS

L-Kynurenine
type: SmallMoleculeReference
xref: Reference/HMDB HMDB0000684
xref: Reference/KEGG Compound C00328
xref: Reference/ChemSpider 141580
xref: Reference/ChEBI CHEBI 16946
xref: Reference/PubChem-compound 161166
xref: Reference/CAS 2922-83-0
xref: Reference/BioCyc L-KYNURENINE
chemical formula: C10H12N2O3
molecular weight: 208.0848
structure: ChemicalStructure/PW C000538

Reference/PubChem-compound 5460337
type: UnificationXref
id: 5460337
db: PubChem-compound

Reference/ChEBI CHEBI 17295
type: UnificationXref
id: CHEBI:17295
db: ChEBI

N-(5-phosphoribosyl)-anthranilate
type: SmallMolecule
entity reference: N-(5-phosphoribosyl)-anthranilate

Reference/KEGG Compound C00065
type: UnificationXref
id: C00065
db: KEGG Compound

Reference/KEGG Compound C00064
type: UnificationXref
id: C00064
db: KEGG Compound

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

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

Compound/PW C000538/Stoichiometry/1.0
type: Stoichiometry
physical entity: L-Kynurenine
stoichiometric coefficient: 1.0

ChemicalStructure/PW C001137
type: ChemicalStructure
structure format: SMILES
structure data: NC1=C(O)C=CC=C1C(O)=O

Reference/HMDB HMDB0000280
type: UnificationXref
id: HMDB0000280
db: HMDB

Reference/HMDB HMDB0000161
type: UnificationXref
id: HMDB0000161
db: HMDB

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

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

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

indole-3-pyruvate
type: SmallMoleculeReference
xref: Reference/PubChem-compound 5460337
chemical formula: C11H8NO3
molecular weight: 202.05042
structure: ChemicalStructure/PW C044565

Tryptophol
type: SmallMoleculeReference
xref: Reference/PubChem-compound 10685
chemical formula: C10H11NO
molecular weight: 161.08406
structure: ChemicalStructure/PW C044566

L-Alanine
type: SmallMoleculeReference
xref: Reference/KEGG Compound C00041
xref: Reference/ChemSpider 5735
xref: Reference/ChEBI CHEBI 16977
xref: Reference/BioCyc L-ALPHA-ALANINE
xref: Reference/HMDB HMDB0000161
xref: Reference/CAS 56-41-7
xref: Reference/PubChem-compound 5950
chemical formula: C3H7NO2
molecular weight: 89.047676
structure: ChemicalStructure/PW C000105

L-Phenylalanine
type: SmallMoleculeReference
xref: Reference/PubChem-compound 6140
xref: Reference/HMDB HMDB0000159
xref: Reference/ChemSpider 5910
xref: Reference/ChEBI CHEBI 17295
xref: Reference/BioCyc PHE
xref: Reference/CAS 63-91-2
xref: Reference/KEGG Compound C00079
chemical formula: C9H11NO2
molecular weight: 165.07898
structure: ChemicalStructure/PW C000104

Indole
type: SmallMoleculeReference
xref: Reference/ChemSpider 776
xref: Reference/PubChem-compound 798
xref: Reference/BioCyc INDOLE
xref: Reference/CAS 120-72-9
xref: Reference/KEGG Compound C00463
xref: Reference/HMDB HMDB0000738
xref: Reference/ChEBI CHEBI 16881
chemical formula: C8H7N
molecular weight: 117.057846
structure: ChemicalStructure/PW C000587

Reference/KEGG Compound C00078
type: UnificationXref
id: C00078
db: KEGG Compound

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

Reference/UniProt P47125
type: UnificationXref
id: P47125
db: UniProt

Reference/KEGG Compound C00079
type: UnificationXref
id: C00079
db: KEGG Compound

Reference/PubChem-compound 10685
type: UnificationXref
id: 10685
db: PubChem-compound

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

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

Reference/ChemSpider 972
type: UnificationXref
id: 972
db: ChemSpider

Compound/PW C000105/Stoichiometry/1.0
type: Stoichiometry
physical entity: L-Alanine
stoichiometric coefficient: 1.0

Oxoglutaric acid
type: SmallMolecule
entity reference: Oxoglutaric acid

Reference/PubChem-compound 729
type: UnificationXref
id: 729
db: PubChem-compound

ChemicalStructure/PW C000095
type: ChemicalStructure
structure format: SMILES
structure data: N[C@@H](CCC(O)=O)C(O)=O

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

Reference/CAS 2922-83-0
type: UnificationXref
id: 2922-83-0
db: CAS

ChemicalStructure/PW C000092
type: ChemicalStructure
structure format: SMILES
structure data: OC=O

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

Reference/ChemSpider 5910
type: UnificationXref
id: 5910
db: ChemSpider

Reference/ChEBI CHEBI 18086
type: UnificationXref
id: CHEBI:18086
db: ChEBI

Reference/UniProt Q04066
type: UnificationXref
id: Q04066
db: UniProt

L-Serine
type: SmallMolecule
entity reference: L-Serine

L-Serine
type: SmallMoleculeReference
xref: Reference/ChemSpider 5736
xref: Reference/ChEBI CHEBI 17115
xref: Reference/CAS 56-45-1
xref: Reference/KEGG Compound C00065
xref: Reference/PubChem-compound 5951
xref: Reference/HMDB HMDB0000187
xref: Reference/BioCyc SER
chemical formula: C3H7NO3
molecular weight: 105.042595
structure: ChemicalStructure/PW C000120

Reference/HMDB HMDB0000187
type: UnificationXref
id: HMDB0000187
db: HMDB

Compound/PW C000869/Stoichiometry/1.0
type: Stoichiometry
physical entity: D-Glyceraldehyde 3-phosphate
stoichiometric coefficient: 1.0

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

Reference/TAXONOMY 4932
type: UnificationXref
id: 4932
db: TAXONOMY

Reference/CAS 64-18-6
type: UnificationXref
id: 64-18-6
db: CAS

Compound/PW C000926/Stoichiometry/1.0
type: Stoichiometry
physical entity: Indoleacetaldehyde
stoichiometric coefficient: 1.0

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

Reference/ChEBI CHEBI 18050
type: UnificationXref
id: CHEBI:18050
db: ChEBI

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

ChemicalStructure/PW C000190
type: ChemicalStructure
structure format: SMILES

1.13.11.6
type: BiochemicalReaction
participant stoichiometry: Compound/PW C001137/Stoichiometry/1.0
participant stoichiometry: Compound/PW C001065/Stoichiometry/1.0
participant stoichiometry: Compound/PW C040034/Stoichiometry/1.0
participant stoichiometry: Compound/PW C001026/Stoichiometry/1.0
right: Hydrogen Ion
right: 2-Amino-3-carboxymuconic acid semialdehyde
spontaneous: false
EC number: 1.13.11.6
left: Oxygen
left: 3-Hydroxyanthranilic acid
name: 3-Hydroxyanthranilic acid + Oxygen → 2-Amino-3-carboxymuconic acid semialdehyde + Hydrogen Ion
conversion direction: LEFT_TO_RIGHT

3.7.1.3
type: BiochemicalReaction
participant stoichiometry: Compound/PW C001420/Stoichiometry/1.0
participant stoichiometry: Compound/PW C001137/Stoichiometry/1.0
participant stoichiometry: Compound/PW C044560/Stoichiometry/1.0
participant stoichiometry: Compound/PW C000105/Stoichiometry/1.0
participant stoichiometry: Compound/PW C040034/Stoichiometry/1.0
right: Hydrogen Ion
right: L-Alanine
right: 3-Hydroxyanthranilic acid
spontaneous: false
EC number: 3.7.1.3
left: Water
left: 3-hydroxy-L-kynurenine
name: 3-hydroxy-L-kynurenine + Water → 3-Hydroxyanthranilic acid + Hydrogen Ion + L-Alanine
conversion direction: LEFT_TO_RIGHT

1.14.13.9
type: BiochemicalReaction
participant stoichiometry: Compound/PW C000146/Stoichiometry/1.0
participant stoichiometry: Compound/PW C001420/Stoichiometry/1.0
participant stoichiometry: Compound/PW C000538/Stoichiometry/1.0
participant stoichiometry: Compound/PW C001065/Stoichiometry/1.0
participant stoichiometry: Compound/PW C044560/Stoichiometry/1.0
participant stoichiometry: Compound/PW C000143/Stoichiometry/1.0
participant stoichiometry: Compound/PW C040034/Stoichiometry/1.0
right: Water
right: NADP
right: 3-hydroxy-L-kynurenine
spontaneous: false
EC number: 1.14.13.9
left: Hydrogen Ion
left: Oxygen
left: NADPH
left: L-Kynurenine
name: Hydrogen Ion + L-Kynurenine + NADPH + Oxygen → 3-hydroxy-L-kynurenine + NADP + Water
conversion direction: LEFT_TO_RIGHT

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

3.5.1.9
type: BiochemicalReaction
participant stoichiometry: Compound/PW C001420/Stoichiometry/1.0
participant stoichiometry: Compound/PW C000092/Stoichiometry/1.0
participant stoichiometry: Compound/PW C000538/Stoichiometry/1.0
participant stoichiometry: Compound/PW C000935/Stoichiometry/1.0
participant stoichiometry: Compound/PW C040034/Stoichiometry/1.0
right: Hydrogen Ion
right: L-Kynurenine
right: Formic acid
spontaneous: false
EC number: 3.5.1.9
left: Water
left: N'-Formylkynurenine
name: N'-Formylkynurenine + Water → Formic acid + Hydrogen Ion + L-Kynurenine
conversion direction: LEFT_TO_RIGHT

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

Reference/ChemSpider 141580
type: UnificationXref
id: 141580
db: ChemSpider

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

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

Carbon dioxide
type: SmallMolecule
entity reference: Carbon dioxide

L-Alanine
type: SmallMolecule
entity reference: L-Alanine

L-Phenylalanine
type: SmallMolecule
entity reference: L-Phenylalanine

Indole
type: SmallMolecule
entity reference: Indole

Reference/CAS 118-92-3
type: UnificationXref
id: 118-92-3
db: CAS

Kynurenine formamidase
type: ProteinReference
xref: Reference/UniProt Q04066

Kynurenine 3-monooxygenase
type: ProteinReference
xref: Reference/UniProt P38169

Indoleamine 2,3-dioxygenase
type: ProteinReference
xref: Reference/UniProt P47125

Kynureninase
type: ProteinReference
xref: Reference/UniProt Q05979

3-hydroxyanthranilate 3,4-dioxygenase
type: ProteinReference
xref: Reference/UniProt P47096

Reference/ChemSpider 30572
type: UnificationXref
id: 30572
db: ChemSpider

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

Multifunctional tryptophan biosynthesis protein
type: Protein
entity reference: Multifunctional tryptophan biosynthesis protein

Anthranilate phosphoribosyltransferase
type: Protein
entity reference: Anthranilate phosphoribosyltransferase

N-(5'-phosphoribosyl)anthranilate isomerase
type: Protein
entity reference: N-(5'-phosphoribosyl)anthranilate isomerase

Tryptophan synthase
type: Protein
entity reference: Tryptophan synthase

2-Amino-3-carboxymuconic acid semialdehyde
type: SmallMolecule
entity reference: 2-Amino-3-carboxymuconic acid semialdehyde

Anthranilate synthase component 1
type: Protein
entity reference: Anthranilate synthase component 1

NADH
type: SmallMolecule
entity reference: NADH

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

Reference/UniProt P38840
type: UnificationXref
id: P38840
db: UniProt

Pyrophosphate
type: SmallMolecule
entity reference: Pyrophosphate

Reference/ChemSpider 4444266
type: UnificationXref
id: 4444266
db: ChemSpider

Reference/CAS 120-72-9
type: UnificationXref
id: 120-72-9
db: CAS

Aromatic/aminoadipate aminotransferase 1
type: Protein
entity reference: Aromatic/aminoadipate aminotransferase 1

Pyruvate decarboxylase isozyme 1
type: Protein
entity reference: Pyruvate decarboxylase isozyme 1

pyruvate decarboxylase 2
type: Protein
entity reference: pyruvate decarboxylase 2

alcohol dehydrogenase subunit I
type: Protein
entity reference: alcohol dehydrogenase subunit I

Pyruvate decarboxylase isozyme 3
type: Protein
entity reference: Pyruvate decarboxylase isozyme 3

alcohol dehydrogenase subunit 2
type: Protein
entity reference: alcohol dehydrogenase subunit 2

Reference/PubChem-compound 5961
type: UnificationXref
id: 5961
db: PubChem-compound

3-Hydroxyanthranilic acid
type: SmallMolecule
entity reference: 3-Hydroxyanthranilic acid

ChemicalStructure/PW C000587
type: ChemicalStructure
structure format: SMILES
structure data: N1C=CC2=C1C=CC=C2

Compound/PW C007748/Stoichiometry/1.0
type: Stoichiometry
physical entity: Chorismate
stoichiometric coefficient: 1.0

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

Pyruvic acid
type: SmallMolecule
entity reference: Pyruvic acid

Reference/ChEBI CHEBI 15846
type: UnificationXref
id: CHEBI:15846
db: ChEBI

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

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

ChemicalStructure/PW C040925
type: ChemicalStructure
structure format: SMILES
structure data: OC1C(O)C(NC2=C(C=CC=C2)C([O-])=O)OC1COP([O-])([O-])=O

Anthranilate synthase component
type: Complex
component: Multifunctional tryptophan biosynthesis protein
component: Anthranilate synthase component 1

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

Reference/ChemSpider 278
type: UnificationXref
id: 278
db: ChemSpider

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

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/PubChem-compound 86
type: UnificationXref
id: 86
db: PubChem-compound

Tryptophan Metabolism
type: Pathway
pathway order: PathwayEnzymeReaction/25317
pathway order: PathwayEnzymeReaction/25318
pathway order: PathwayEnzymeReaction/25319
pathway order: PathwayEnzymeReaction/25309
pathway order: PathwayEnzymeReaction/25320
pathway order: PathwayEnzymeReaction/25310
pathway order: PathwayEnzymeReaction/25321
pathway order: PathwayEnzymeReaction/25311
pathway order: PathwayEnzymeReaction/25322
pathway order: PathwayEnzymeReaction/25312
pathway order: PathwayEnzymeReaction/25323
pathway order: PathwayEnzymeReaction/25313
pathway order: PathwayEnzymeReaction/25324
pathway order: PathwayEnzymeReaction/25314
pathway order: PathwayEnzymeReaction/25315
pathway order: PathwayEnzymeReaction/25316
pathway component: ReactionCatalysis6451
pathway component: ReactionCatalysis6450
pathway component: 4.1.3.27
pathway component: 2.4.2.18
pathway component: 5.3.1.24
pathway component: ReactionCatalysis6455
pathway component: ReactionCatalysis6454
pathway component: ReactionCatalysis6453
pathway component: 1.13.11.6
pathway component: ReactionCatalysis6452
pathway component: 3.7.1.3
pathway component: 1.14.13.9
pathway component: 3.5.1.9
pathway component: ReactionCatalysis6457
pathway component: ReactionCatalysis6456
pathway component: ReactionCatalysis6408
pathway component: Reaction6535
pathway component: ReactionCatalysis6407
pathway component: Reaction6536
pathway component: ReactionCatalysis6406
pathway component: Reaction6537
pathway component: ReactionCatalysis6449
pathway component: Reaction6538
pathway component: ReactionCatalysis6409
pathway component: Reaction6530
pathway component: ReactionCatalysis6448
pathway component: 4.2.1.20
pathway component: ReactionCatalysis6447
pathway component: Reaction6532
pathway component: Reaction6533
pathway component: Reaction6534
xref: Reference/PathWhiz PW002442
xref: Reference/SMPDB SMP0002353
organism: Saccharomyces cerevisiae

pyruvate decarboxylase
type: Complex
component: Pyruvate decarboxylase isozyme 1
component: pyruvate decarboxylase 2
component: Pyruvate decarboxylase isozyme 3

Reference/ChEBI CHEBI 16908
type: UnificationXref
id: CHEBI:16908
db: ChEBI

Compound/PW C000877/Stoichiometry/1.0
type: Stoichiometry
physical entity: 2-Aminobenzoic acid
stoichiometric coefficient: 1.0

NADPH
type: SmallMolecule
entity reference: NADPH

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

Reference/HMDB HMDB0000684
type: UnificationXref
id: HMDB0000684
db: HMDB

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

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

Reference/ChEBI CHEBI 16977
type: UnificationXref
id: CHEBI:16977
db: ChEBI

Reference/BioCyc 3-HYDROXY-ANTHRANILATE
type: UnificationXref
id: 3-HYDROXY-ANTHRANILATE
db: BioCyc

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

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

N-(5-phosphoribosyl)-anthranilate
type: SmallMoleculeReference
xref: Reference/ChEBI CHEBI 18277
chemical formula: C12H13NO9P
molecular weight: 346.03442
structure: ChemicalStructure/PW C040925

Reference/CAS 58-68-4
type: UnificationXref
id: 58-68-4
db: CAS

L-Glutamic acid
type: SmallMolecule
entity reference: L-Glutamic acid

Phosphoribosyl pyrophosphate
type: SmallMoleculeReference
xref: Reference/KEGG Compound C00119
xref: Reference/ChemSpider 7062
xref: Reference/CAS 7540-64-9
xref: Reference/HMDB HMDB0000280
xref: Reference/PubChem-compound 7339
xref: Reference/BioCyc PRPP
xref: Reference/ChEBI CHEBI 17111
chemical formula: C5H13O14P3
molecular weight: 389.9518
structure: ChemicalStructure/PW C000190

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

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

Formic acid
type: SmallMolecule
entity reference: Formic acid

Reference/PubChem-compound 798
type: UnificationXref
id: 798
db: PubChem-compound

Reference/PubChem-compound 46878464
type: UnificationXref
id: 46878464
db: PubChem-compound

Reference/CAS 548-93-6
type: UnificationXref
id: 548-93-6
db: CAS

ChemicalStructure/PW C000143
type: ChemicalStructure
structure format: SMILES

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

Reference/PubChem-compound 5280673
type: UnificationXref
id: 5280673
db: PubChem-compound

ChemicalStructure/PW C000146
type: ChemicalStructure
structure format: SMILES

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

Reference/UniProt P53090
type: UnificationXref
id: P53090
db: UniProt

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

Reference/CAS 2591-98-2
type: UnificationXref
id: 2591-98-2
db: CAS

Reference/SMPDB SMP0002353
type: UnificationXref
id: SMP0002353
db: SMPDB

Compound/PW C000120/Stoichiometry/1.0
type: Stoichiometry
physical entity: L-Serine
stoichiometric coefficient: 1.0

Reference/BioCyc INDOLE ACETALDEHYDE
type: UnificationXref
id: INDOLE_ACETALDEHYDE
db: BioCyc

Kynurenine formamidase
type: Protein
entity reference: Kynurenine formamidase

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

Indoleamine 2,3-dioxygenase
type: Protein
entity reference: Indoleamine 2,3-dioxygenase

3-hydroxyanthranilate 3,4-dioxygenase
type: Protein
entity reference: 3-hydroxyanthranilate 3,4-dioxygenase

Reference/PubChem-compound 227
type: UnificationXref
id: 227
db: PubChem-compound

Kynureninase
type: Protein
entity reference: Kynureninase

Kynurenine 3-monooxygenase
type: Protein
entity reference: Kynurenine 3-monooxygenase

3-Hydroxyanthranilic acid
type: SmallMoleculeReference
xref: Reference/HMDB HMDB0001476
xref: Reference/BioCyc 3-HYDROXY-ANTHRANILATE
xref: Reference/PubChem-compound 86
xref: Reference/KEGG Compound C00632
xref: Reference/ChemSpider 84
xref: Reference/CAS 548-93-6
xref: Reference/ChEBI CHEBI 15793
chemical formula: C7H7NO3
molecular weight: 153.04259
structure: ChemicalStructure/PW C001137

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

ChemicalStructure/PW C000105
type: ChemicalStructure
structure format: SMILES
structure data: C[C@H](N)C(O)=O

ChemicalStructure/PW C000104
type: ChemicalStructure
structure format: SMILES
structure data: N[C@@H](CC1=CC=CC=C1)C(O)=O

Reference/PubChem-compound 5950
type: UnificationXref
id: 5950
db: PubChem-compound

Reference/PubChem-compound 5951
type: UnificationXref
id: 5951
db: PubChem-compound

Reference/PubChem-compound 161166
type: UnificationXref
id: 161166
db: PubChem-compound

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/HMDB HMDB0001200
type: UnificationXref
id: HMDB0001200
db: HMDB

NADH
type: SmallMoleculeReference
xref: Reference/HMDB HMDB0001487
xref: Reference/CAS 58-68-4
xref: Reference/PubChem-compound 439153
xref: Reference/BioCyc NADH
xref: Reference/ChemSpider 388299
xref: Reference/KEGG Compound C00004
xref: Reference/ChEBI CHEBI 16908
chemical formula: C21H29N7O14P2
molecular weight: 665.12476
structure: ChemicalStructure/PW C001144

2-Amino-3-carboxymuconic acid semialdehyde
type: SmallMoleculeReference
xref: Reference/ChemSpider 4444266
xref: Reference/PubChem-compound 5280673
xref: Reference/ChEBI CHEBI 995
xref: Reference/KEGG Compound C04409
xref: Reference/CAS 16597-58-3
xref: Reference/BioCyc 2-AMINO-3-CARBOXYMUCONATE SEMIAL
xref: Reference/HMDB HMDB0001330
chemical formula: C7H7NO5
molecular weight: 185.03242
structure: ChemicalStructure/PW C001026

Reference/ChEBI CHEBI 16946
type: UnificationXref
id: CHEBI:16946
db: ChEBI

Compound/PW C000587/Stoichiometry/1.0
type: Stoichiometry
physical entity: Indole
stoichiometric coefficient: 1.0

Reference/ChEBI CHEBI 16828
type: UnificationXref
id: CHEBI:16828
db: ChEBI

Phosphoribosyl pyrophosphate
type: SmallMolecule
entity reference: Phosphoribosyl pyrophosphate

Reference/ChemSpider 6066
type: UnificationXref
id: 6066
db: ChemSpider

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

ChemicalStructure/PW C000120
type: ChemicalStructure
structure format: SMILES
structure data: N[C@@H](CO)C(O)=O

Reference/ChemSpider 222
type: UnificationXref
id: 222
db: ChemSpider

Reference/PubChem-compound 49791998
type: UnificationXref
id: 49791998
db: PubChem-compound

Reference/HMDB HMDB0001330
type: UnificationXref
id: HMDB0001330
db: HMDB

Compound/PW C000721/Stoichiometry/1.0
type: Stoichiometry
physical entity: NAD
stoichiometric coefficient: 1.0

ChemicalStructure/PW C000721
type: ChemicalStructure
structure format: SMILES

Reference/PubChem-compound 6305
type: UnificationXref
id: 6305
db: PubChem-compound

Reference/HMDB HMDB0000929
type: UnificationXref
id: HMDB0000929
db: HMDB

Reference/ChemSpider 5682
type: UnificationXref
id: 5682
db: ChemSpider

Compound/PW C001137/Stoichiometry/1.0
type: Stoichiometry
physical entity: 3-Hydroxyanthranilic acid
stoichiometric coefficient: 1.0

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

Chorismate
type: SmallMoleculeReference
xref: Reference/CAS 617-12-9
xref: Reference/BioCyc CPD-9517
xref: Reference/KEGG Compound C00251
xref: Reference/PubChem-compound 12039
xref: Reference/ChEBI CHEBI 17333
xref: Reference/ChemSpider 11542
xref: Reference/HMDB HMDB0012199
chemical formula: C10H10O6
molecular weight: 226.04774
structure: ChemicalStructure/PW C007748

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

ChemicalStructure/PW C000741
type: ChemicalStructure
structure format: SMILES
structure data: N[C@@H](CC1=CNC2=C1C=CC=C2)C(O)=O

Reference/PubChem-compound 18971002
type: UnificationXref
id: 18971002
db: PubChem-compound

ChemicalStructure/PW C044565
type: ChemicalStructure
structure format: SMILES
structure data: [O-]C(=O)C(=O)CC1=CNC2=C1C=CC=C2

ChemicalStructure/PW C044564
type: ChemicalStructure
structure format: SMILES
structure data: [H][C@@](O)(COP([O-])([O-])=O)[C@@]([H])(O)C1=CNC2=CC=CC=C12

Reference/ChemSpider 11542
type: UnificationXref
id: 11542
db: ChemSpider

ChemicalStructure/PW C044560
type: ChemicalStructure
structure format: SMILES
structure data: N[C@@H](CC(=O)C1=CC=CC(O)=C1N)C(O)=O

1-(2-carboxyphenylamino)-1-deoxy-D-ribulose 5-phosphate
type: SmallMolecule
entity reference: 1-(2-carboxyphenylamino)-1-deoxy-D-ribulose 5-phosphate

ChemicalStructure/PW C044566
type: ChemicalStructure
structure format: SMILES
structure data: OCCC1=CNC2=C1C=CC=C2

Reference/UniProt P07285
type: UnificationXref
id: P07285
db: UniProt

Reference/ChemSpider 388299
type: UnificationXref
id: 388299
db: ChemSpider

Compound/PW C001026/Stoichiometry/1.0
type: Stoichiometry
physical entity: 2-Amino-3-carboxymuconic acid semialdehyde
stoichiometric coefficient: 1.0

Chorismate
type: SmallMolecule
entity reference: Chorismate

Reference/CAS 617-12-9
type: UnificationXref
id: 617-12-9
db: CAS

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

Formic acid
type: SmallMoleculeReference
xref: Reference/ChEBI CHEBI 30751
xref: Reference/ChemSpider 278
xref: Reference/PubChem-compound 18971002
xref: Reference/BioCyc FORMATE
xref: Reference/CAS 64-18-6
xref: Reference/KEGG Compound C00058
xref: Reference/HMDB HMDB0000142
chemical formula: CH2O2
molecular weight: 46.005478
structure: ChemicalStructure/PW C000092

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

Compound/PW C044565/Stoichiometry/1.0
type: Stoichiometry
physical entity: indole-3-pyruvate
stoichiometric coefficient: 1.0

Reference/UniProt P00899
type: UnificationXref
id: P00899
db: UniProt

L-Glutamic acid
type: SmallMoleculeReference
xref: Reference/PubChem-compound 33032
xref: Reference/ChEBI CHEBI 16015
xref: Reference/ChemSpider 30572
xref: Reference/HMDB HMDB0000148
xref: Reference/CAS 56-86-0
xref: Reference/BioCyc GLT
xref: Reference/KEGG Compound C00025
chemical formula: C5H9NO4
molecular weight: 147.05316
structure: ChemicalStructure/PW C000095

Reference/PubChem-compound 33032
type: UnificationXref
id: 33032
db: PubChem-compound

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

Compound/PW C001144/Stoichiometry/1.0
type: Stoichiometry
physical entity: NADH
stoichiometric coefficient: 1.0

Compound/PW C040925/Stoichiometry/1.0
type: Stoichiometry
physical entity: N-(5-phosphoribosyl)-anthranilate
stoichiometric coefficient: 1.0

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

Reference/ChEBI CHEBI 15793
type: UnificationXref
id: CHEBI:15793
db: ChEBI

Reference/ChEBI CHEBI 16881
type: UnificationXref
id: CHEBI:16881
db: ChEBI

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

ReactionCatalysis6408
type: Catalysis
controller: Kynurenine 3-monooxygenase
controlled: 1.14.13.9
control type: ACTIVATION

ReactionCatalysis6407
type: Catalysis
controller: Kynureninase
controlled: 3.7.1.3
control type: ACTIVATION

ReactionCatalysis6406
type: Catalysis
controller: 3-hydroxyanthranilate 3,4-dioxygenase
controlled: 1.13.11.6
control type: ACTIVATION

Compound/PW C044560/Stoichiometry/1.0
type: Stoichiometry
physical entity: 3-hydroxy-L-kynurenine
stoichiometric coefficient: 1.0

ReactionCatalysis6409
type: Catalysis
controller: Kynurenine formamidase
controlled: 3.5.1.9
control type: ACTIVATION

ChemicalStructure/PW C012810
type: ChemicalStructure
structure format: SMILES
structure data: OC(=O)C(=O)CC1=CC=CC=C1

Reference/BioCyc CPD-9517
type: UnificationXref
id: CPD-9517
db: BioCyc

N'-Formylkynurenine
type: SmallMolecule
entity reference: N'-Formylkynurenine

Reference/PathWhiz PW002442
type: UnificationXref
id: PW002442
db: PathWhiz

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

Reference/KEGG Compound C00637
type: UnificationXref
id: C00637
db: KEGG Compound

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

Reference/KEGG Compound C00632
type: UnificationXref
id: C00632
db: KEGG Compound

Reference/PubChem-compound 5893
type: UnificationXref
id: 5893
db: PubChem-compound

Reference/BioCyc L-KYNURENINE
type: UnificationXref
id: L-KYNURENINE
db: BioCyc

Reference/ChEBI CHEBI 30754
type: UnificationXref
id: CHEBI:30754
db: ChEBI

Reference/ChEBI CHEBI 30751
type: UnificationXref
id: CHEBI:30751
db: ChEBI

Reference/UniProt Q05979
type: UnificationXref
id: Q05979
db: UniProt

Compound/PW C042673/Stoichiometry/1.0
type: Stoichiometry
physical entity: 1-(2-carboxyphenylamino)-1-deoxy-D-ribulose 5-phosphate
stoichiometric coefficient: 1.0

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

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

Indoleacetaldehyde
type: SmallMolecule
entity reference: Indoleacetaldehyde

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+]

Reference/CAS 56-45-1
type: UnificationXref
id: 56-45-1
db: CAS

Reference/HMDB HMDB0000738
type: UnificationXref
id: HMDB0000738
db: HMDB

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

ChemicalStructure/PW C000538
type: ChemicalStructure
structure format: SMILES
structure data: N[C@@H](CC(=O)C1=CC=CC=C1N)C(O)=O

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

aromatic amino acid aminotransferase II
type: Protein
entity reference: aromatic amino acid aminotransferase II

ChemicalStructure/PW C000500
type: ChemicalStructure
structure format: SMILES
structure data: N[C@@H](CCC(N)=O)C(O)=O

Compound/PW C044566/Stoichiometry/1.0
type: Stoichiometry
physical entity: Tryptophol
stoichiometric coefficient: 1.0

ChemicalStructure/PW C000869
type: ChemicalStructure
structure format: SMILES
structure data: OC(COP(O)(O)=O)C=O

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

Reference/BioCyc N-FORMYLKYNURENINE
type: UnificationXref
id: N-FORMYLKYNURENINE
db: BioCyc

Reference/ChEBI CHEBI 30851
type: UnificationXref
id: CHEBI:30851
db: ChEBI

Reference/UniProt Q04894
type: UnificationXref
id: Q04894
db: UniProt

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

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

Reference/UniProt P06169
type: UnificationXref
id: P06169
db: UniProt

ChemicalStructure/PW C000877
type: ChemicalStructure
structure format: SMILES
structure data: NC1=CC=CC=C1C(O)=O

Reference/KEGG Compound C00661
type: UnificationXref
id: C00661
db: KEGG Compound

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

Reference/PubChem-compound 12039
type: UnificationXref
id: 12039
db: PubChem-compound

Reference/HMDB HMDB0000641
type: UnificationXref
id: HMDB0000641
db: HMDB

alcohol dehydrogenase
type: Complex
component: alcohol dehydrogenase subunit I
component: alcohol dehydrogenase subunit 2