Structure of PDB 8qay Chain B Binding Site BS02

Receptor Information
>8qay Chain B (length=185) Species: 3880 (Medicago truncatula) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
GARIGEMKRVTKETNVSVKINLDGTGVADNSSGIPFLDHMLDQLASHGLF
DVHVKATGDTHIDDHHTNEDVALAIGTALLQALGDRKGINRFGNFSAPLD
EALVHVSLDLSGRPHLGYDLNIPTQRVGKYDTQLVEHFFQSLVNTSGMTL
HIRQFSGTNSHHIIEATFKAFARALRQATEYDTRR
Ligand information
Ligand IDMN
InChIInChI=1S/Mn/q+2
InChIKeyWAEMQWOKJMHJLA-UHFFFAOYSA-N
SMILES
SoftwareSMILES
ACDLabs 10.04
OpenEye OEToolkits 1.5.0		[Mn+2]
CACTVS 3.341[Mn++]
FormulaMn
NameMANGANESE (II) ION
ChEMBL
DrugBankDB06757
ZINC
PDB chain8qay Chain B Residue 303 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
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PDB8qay Targeting imidazole-glycerol phosphate dehydratase in plants: novel approach for structural and functional studies, and inhibitor blueprinting.
Resolution2.2 Å
Binding residue
(original residue number in PDB)		H141 E145 H213
Binding residue
(residue number reindexed from 1)		H65 E69 H137
Annotation score1
Enzymatic activity
Enzyme Commision number 4.2.1.19: imidazoleglycerol-phosphate dehydratase.
Gene Ontology
Molecular Function
GO:0004424 imidazoleglycerol-phosphate dehydratase activity
Biological Process
GO:0000105 L-histidine biosynthetic process

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Molecular Function
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Biological Process
External links
PDB RCSB:8qay, PDBe:8qay, PDBj:8qay
PDBsum8qay
PubMed38559763
UniProtA0A072VQG6

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