Structure of PDB 7etx Chain A Binding Site BS01

Receptor Information
>7etx Chain A (length=472) Species: 196627 (Corynebacterium glutamicum ATCC 13032) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
NNLPTVLESIVEGRRGHLEEIRARIAHVDVDALPKSTRSLFDSLNQGRGG
ARFIMECKSASPSLGMIREHYQPGEIARVYSRYASGISVLCEPDRFGGDY
DHLATVAATSHLPVLCKDFIIDPVQVHAARYFGADAILLMLSVLDDEEYA
ALAAEAARFDLDILTEVIDEEEVARAIKLGAKIFGVNHRNLHDLSIDLDR
SRRLSKLIPADAVLVSESGVRDTETVRQLGGHSNAFLVGSQLTSQENVDL
AARELVYGPNKVCGLTSPSAAQTARAAGAVYGGLIFEEASPRNVSRETLQ
KIIAAEPNLRYVAVSRRTSGYKDLLVDGIFAVQIHAPLQDSVEAEKALIA
AVREEVGPQVQVWRAISMSSPLGAEVAAAVEGDVDKLILDAHEGGSGEVF
DWATVPAAVKAKSLLAGGISPDNAAQALAVGCAGLDINSGVEYPAGAGTW
AGAKDAGALLKIFATISTFHYL
Ligand information
Ligand IDGOL
InChIInChI=1S/C3H8O3/c4-1-3(6)2-5/h3-6H,1-2H2
InChIKeyPEDCQBHIVMGVHV-UHFFFAOYSA-N
SMILES
SoftwareSMILES
OpenEye OEToolkits 1.7.0C(C(CO)O)O
ACDLabs 12.01
CACTVS 3.370		OCC(O)CO
FormulaC3 H8 O3
NameGLYCEROL;
GLYCERIN;
PROPANE-1,2,3-TRIOL
ChEMBLCHEMBL692
DrugBankDB09462
ZINCZINC000000895048
PDB chain7etx Chain A Residue 501 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
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PDB7etx Crystal Structure and Functional Characterization of the Bifunctional N -(5'-Phosphoribosyl)anthranilate Isomerase-indole-3-glycerol-phosphate Synthase from Corynebacterium glutamicum
Resolution2.1 Å
Binding residue
(original residue number in PDB)		T40 R133 D138
Binding residue
(residue number reindexed from 1)		T37 R130 D135
Annotation score1
Enzymatic activity
Enzyme Commision number 4.1.1.48: indole-3-glycerol-phosphate synthase.
5.3.1.24: phosphoribosylanthranilate isomerase.
Gene Ontology
Molecular Function
GO:0004425 indole-3-glycerol-phosphate synthase activity
GO:0004640 phosphoribosylanthranilate isomerase activity
GO:0016830 carbon-carbon lyase activity
GO:0016831 carboxy-lyase activity
GO:0016853 isomerase activity
Biological Process
GO:0000162 tryptophan biosynthetic process
GO:0006568 tryptophan metabolic process

View graph for
Molecular Function
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Biological Process
External links
PDB RCSB:7etx, PDBe:7etx, PDBj:7etx
PDBsum7etx
PubMed34657425
UniProtP06560|TRPC_CORGL Tryptophan biosynthesis protein TrpCF (Gene Name=trpC)

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