Structure of PDB 8sm9 Chain F Binding Site BS01

Receptor Information
>8sm9 Chain F (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 F Residue 401 [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)		D34 H36 H212 E264 D336
Binding residue
(residue number reindexed from 1)		D6 H8 H184 E236 D308
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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