Structure of PDB 8eh1 Chain A Binding Site BS02

Receptor Information
>8eh1 Chain A (length=383) Species: 2336 (Thermotoga maritima) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
GNFGPYGGQNVPEILMGALEELEAAYEGIMKDESFWKEYNDLLRDYAGRP
TPLYFARRLSEKYGARVYLKREDLLHTGAHKINNAIGQVLLAKLMGKTRI
TAGTGAGQHGVATATAAALFGMECVIYMGEEDTIRQKLNVERMKLLGAKV
VPVKSGSRTLKDAIDEALRDWITNLQTTYYVPGSVVGPHPYPIIVRNFQK
VIGEETKKQIPEKEGRLPDYIVACVSGGSNAAGIFYPFIDSGVKLIGVEA
GGEGLETGKHAASLLKGKIGYLHGSKTFVLQDDWGQVQASHSVSAGLDYP
GVGPEHAYWRETGKVLYDAVTDEEALDAFIELSRLEGIIPALESSHALAY
LKKINIKGKVVVVNLSGRGDKDLESVLNHPYVR
Ligand information
Ligand IDES1
InChIInChI=1S/C9H7NO/c11-9-5-6-10-8-4-2-1-3-7(8)9/h1-6H,(H,10,11)
InChIKeyPMZDQRJGMBOQBF-UHFFFAOYSA-N
SMILES
SoftwareSMILES
OpenEye OEToolkits 1.7.0c1ccc2c(c1)c(ccn2)O
CACTVS 3.352Oc1ccnc2ccccc12
FormulaC9 H7 N O
Namequinolin-4-ol
ChEMBLCHEMBL1232567
DrugBank
ZINCZINC000008579890
PDB chain8eh1 Chain A Residue 402 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
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PDB8eh1 Towards automated crystallographic structure refinement with phenix.refine.
Resolution2.0 Å
Binding residue
(original residue number in PDB)		G105 L162 I166 G185 S186 Y301
Binding residue
(residue number reindexed from 1)		G103 L160 I164 G183 S184 Y299
Annotation score1
Enzymatic activity
Enzyme Commision number 4.2.1.20: tryptophan synthase.
Gene Ontology
Molecular Function
GO:0004834 tryptophan synthase activity
GO:0016829 lyase activity
Biological Process
GO:0000162 tryptophan biosynthetic process
GO:0006568 tryptophan metabolic process
Cellular Component
GO:0005737 cytoplasm

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Molecular Function
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Biological Process
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Cellular Component
External links
PDB RCSB:8eh1, PDBe:8eh1, PDBj:8eh1
PDBsum8eh1
PubMed38744987
UniProtP50909|TRPB1_THEMA Tryptophan synthase beta chain 1 (Gene Name=trpB1)

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