Structure of PDB 1sb3 Chain F Binding Site BS02

Receptor Information
>1sb3 Chain F (length=157) Species: 59405 (Thauera aromatica) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
MKNILRLTLNGRAREDLVPDNMLLLDYLRETVGLTGTKQGCDGGECGACT
VLVDDRPRLACSTLAHQVAGKKVETVESLATQGTLSKLQAAFHEKLGTQC
GFCTPGMIMASEALLRKNPSPSRDEIKAALAGNLCRCTGYVKIIKSVETA
AAARLCE
Ligand information
Ligand IDFES
InChIInChI=1S/2Fe.2S
InChIKeyNIXDOXVAJZFRNF-UHFFFAOYSA-N
SMILES
SoftwareSMILES
ACDLabs 10.04[Fe]1S[Fe]S1
CACTVS 3.341
OpenEye OEToolkits 1.5.0		S1[Fe]S[Fe]1
FormulaFe2 S2
NameFE2/S2 (INORGANIC) CLUSTER
ChEMBL
DrugBank
ZINC
PDB chain1sb3 Chain F Residue 1917 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
Global viewLocal viewStructure summary

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PDB1sb3 Structure of a Xanthine Oxidase-Related 4-Hydroxybenzoyl-CoA Reductase with an Additional [4Fe-4S] Cluster and an Inverted Electron Flow.
Resolution2.2 Å
Binding residue
(original residue number in PDB)		C100 G101 C103 C135 C137
Binding residue
(residue number reindexed from 1)		C100 G101 C103 C135 C137
Annotation score3
Enzymatic activity
Enzyme Commision number 1.1.7.1: 4-hydroxybenzoyl-CoA reductase.
Gene Ontology
Molecular Function
GO:0016491 oxidoreductase activity
GO:0018525 4-hydroxybenzoyl-CoA reductase activity
GO:0046872 metal ion binding
GO:0051536 iron-sulfur cluster binding
GO:0051537 2 iron, 2 sulfur cluster binding

View graph for
Molecular Function
External links
PDB RCSB:1sb3, PDBe:1sb3, PDBj:1sb3
PDBsum1sb3
PubMed15576037
UniProtO33818|HCRC_THAAR 4-hydroxybenzoyl-CoA reductase subunit gamma (Gene Name=hcrC)

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