Structure of PDB 8sm7 Chain A Binding Site BS02

Receptor Information
>8sm7 Chain A (length=347) Species: 481743 (Paenibacillus sp. Y412MC10) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
KIIDVDVHNEQDDRALLPYLQEPWRSRVAASGIGYAGSGYYSPIGVMKKD
SIPPGGGKAGSDPDYMIKQLIEGYNLDYAVLTGVVYNISSTHDPDYAAAI
CSAYNDYLIAEWLGKHKAFKGALAVATQDPLLAAREIDRIGGHPDIVEVM
ISSAARSPLGQRHYHPIYEAAARNGLPVAIHPGAEGGGSSTAPTAAGYPT
RYIEWHTCLSQMFMAHLVSMVCEGVFVKYPNLKVVLVEGGVAWLPGLMWR
LDKNYKALRATVPWLTRMPSEYIRDHCYLSTQPIEEPDNPQHLIDLFNMI
DAENMLLYSSDYPHWDFDSPGHVLRGLKPEARRKIFYENAKQLYRLD
Ligand information
Ligand IDFE
InChIInChI=1S/Fe/q+3
InChIKeyVTLYFUHAOXGGBS-UHFFFAOYSA-N
SMILES
SoftwareSMILES
ACDLabs 10.04
CACTVS 3.341
OpenEye OEToolkits 1.5.0		[Fe+3]
FormulaFe
NameFE (III) ION
ChEMBL
DrugBankDB13949
ZINC
PDB chain8sm7 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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PDB8sm7 Bioinformatic Discovery of a Cambialistic Monooxygenase.
Resolution2.2 Å
Binding residue
(original residue number in PDB)		E242 D315 H318
Binding residue
(residue number reindexed from 1)		E238 D311 H314
Annotation score4
Enzymatic activity
Enzyme Commision number ?
Gene Ontology
Molecular Function
GO:0016787 hydrolase activity
GO:0016829 lyase activity
GO:0016831 carboxy-lyase activity
GO:0046872 metal ion binding
Biological Process
GO:0019748 secondary 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:8sm7, PDBe:8sm7, PDBj:8sm7
PDBsum8sm7
PubMed38198693
UniProtD3EI84

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