Structure of PDB 7bpc Chain A Binding Site BS01

Receptor Information
>7bpc Chain A (length=334) Species: 5507 (Fusarium oxysporum) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
MLGKVALEEAFALPRHKERTRWWAGLFAIDPDKHAAEINDITEQRIKYMN
EHGVGYTILSYTAPGVQDVWDPKEAQALAVEVNDYIADAIKAHPDRLGAF
ATLSMHDPKEAAEELRRVVTKYGFKGALVNDTQRAGADGDDMIFYDGPEW
DVFWSTVTDLDVPFYLHPRNPTGSIHEKLWAKRSWLIGPPLSFAQGVSLH
ALGMVTNGVFDRHPKLQIVLGHLGEHIPFDMWRINHWFEDIKKPLGLSCK
LTIREYFARNLWITTSGHFSTSTLQFCLGEVGADRILFSIDYPFENFSDA
CTWYDGLAINDVDKRKIGKDNAKKLFKLPQFYQS
Ligand information
Ligand IDGTQ
InChIInChI=1S/C7H6O4/c8-4-1-2-6(9)5(3-4)7(10)11/h1-3,8-9H,(H,10,11)
InChIKeyWXTMDXOMEHJXQO-UHFFFAOYSA-N
SMILES
SoftwareSMILES
ACDLabs 11.02O=C(O)c1cc(O)ccc1O
OpenEye OEToolkits 1.7.0c1cc(c(cc1O)C(=O)O)O
CACTVS 3.352OC(=O)c1cc(O)ccc1O
FormulaC7 H6 O4
Name2,5-dihydroxybenzoic acid
ChEMBLCHEMBL1461
DrugBank
ZINCZINC000000001507
PDB chain7bpc Chain A Residue 401 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
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PDB7bpc 2,3-Dihydroxybenzoic Acid Decarboxylase from Fusarium oxysporum: Crystal Structures and Substrate Recognition Mechanism.
Resolution2.45 Å
Binding residue
(original residue number in PDB)		W24 F28 A64 F194 F295
Binding residue
(residue number reindexed from 1)		W23 F27 A63 F193 F294
Annotation score1
Enzymatic activity
Enzyme Commision number ?
Gene Ontology
Molecular Function
GO:0016787 hydrolase activity
GO:0016831 carboxy-lyase activity
GO:0046872 metal ion binding
Biological Process
GO:0019748 secondary metabolic process
Cellular Component
GO:0005737 cytoplasm
GO:0005829 cytosol

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Molecular Function
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Biological Process
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Cellular Component
External links
PDB RCSB:7bpc, PDBe:7bpc, PDBj:7bpc
PDBsum7bpc
PubMed32421914
UniProtN1S495

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