Structure of PDB 8sm9 Chain B Binding Site BS02

Receptor Information
>8sm9 Chain B (length=344) Species: 1307436 (Cytobacillus firmus DS1) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
KVIDTDIHHDIASVDDLVPYLSDHWKRYITEYNWKPIKTTPFHQVRSGTK
YRGDSFGESKRPPGSDFELLKKQLLDEHEITYGVLGGWFHEATVATGWFE
FAAARAAAYNDYTIEQWLNKDERLLGSITIPADPVAAVREIDRVGPHPQM
VQVMMSIGNFAWGDPRFHPIFEAAERHGLAIGMHLSADITFQGGEFLRYY
VAWRAAHPQAYMTQVISLITNGVFDKYPNLKVALIEGGFEWVPFMMNRMD
AAYKGLRQETPWVKRMPSDYFRDNMRFSTQPWHDISAKHFLDIIDMMGSD
KMLMFSTDYPHWDFDAPKRTLPPKISDDLKNKILYENARELYNL
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 chain8sm9 Chain B Residue 402 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
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PDB8sm9 Bioinformatic Discovery of a Cambialistic Monooxygenase.
Resolution2.3 Å
Binding residue
(original residue number in PDB)		E264 D336 H339
Binding residue
(residue number reindexed from 1)		E236 D308 H311
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:8sm9, PDBe:8sm9, PDBj:8sm9
PDBsum8sm9
PubMed38198693
UniProtW7L2Y2

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