Structure of PDB 8sm8 Chain A Binding Site BS01

Receptor Information
>8sm8 Chain A (length=344) Species: 504832 (Afipia carboxidovorans OM5) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
HIIDTDVHESFASLKDLVPYLPEPYKSWIGNGAWRGFSQPFAYTSPGNGN
RADVKSADGSASVSDYNLMRSQLLDPYKLSYAVLTGYFYPTGLKLQYGLG
SALASAYNDYVLEHWISKDKRFLGSVQINARDPEAAAREIDRMAAHPQIR
QVMLPVVDDIAYGHPMYRPIFAAAERNKLMVAFHHTTFAQGPYGMGLHYM
ERHCLIPISLMPQVISLIANGVFDSYPNLRFMVLEGGFSWLPHVMWRMDR
EYRQGRVEVPWIKKLPSQHCRERLRLSTQPTEDISGEDWGKLIDLMGTDD
ILVFSTDYPHFDFDDPNAAIPKSLSSGTRDKILWKNAADFYGLD
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 chain8sm8 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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PDB8sm8 Bioinformatic Discovery of a Cambialistic Monooxygenase.
Resolution2.0 Å
Binding residue
(original residue number in PDB)		D7 H9 H185 E236 D308
Binding residue
(residue number reindexed from 1)		D6 H8 H184 E235 D307
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:8sm8, PDBe:8sm8, PDBj:8sm8
PDBsum8sm8
PubMed38198693
UniProtB6JH23

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