Structure of PDB 3h31 Chain A Binding Site BS01

Receptor Information
>3h31 Chain A (length=74) Species: 29549 (Rhodothermus marinus) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
AELTCTDVSGLTAEEIQMRESLQYTDHSPYPDKTCANCQLYVPAESPDQC
GGCQLIKGPIHPNGYCTSWVQKAT
Ligand information
Ligand IDSF4
InChIInChI=1S/4Fe.4S
InChIKeyLJBDFODJNLIPKO-UHFFFAOYSA-N
SMILES
SoftwareSMILES
OpenEye OEToolkits 2.0.7[S]12[Fe]3[S]4[Fe]1[S]5[Fe]2[S]3[Fe]45
CACTVS 3.385S1[Fe]S[Fe]1.S2[Fe]S[Fe]2
FormulaFe4 S4
NameIRON/SULFUR CLUSTER
ChEMBL
DrugBank
ZINC
PDB chain3h31 Chain A Residue 75 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
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PDB3h31 Structure at 1.0 A resolution of a high-potential iron-sulfur protein involved in the aerobic respiratory chain of Rhodothermus marinus
Resolution1.0 Å
Binding residue
(original residue number in PDB)		C35 C38 Y41 C53 C66 W69
Binding residue
(residue number reindexed from 1)		C35 C38 Y41 C53 C66 W69
Annotation score4
Enzymatic activity
Enzyme Commision number ?
Gene Ontology
Molecular Function
GO:0009055 electron transfer activity
Biological Process
GO:0019646 aerobic electron transport chain

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Molecular Function
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Biological Process
External links
PDB RCSB:3h31, PDBe:3h31, PDBj:3h31
PDBsum3h31
PubMed20225399
UniProtC4P582

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