Structure of PDB 2ams Chain A Binding Site BS01

Receptor Information
>2ams Chain A (length=83) Species: 1049 (Allochromatium vinosum) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
AAPANAVTADDPTAIALKYNQDATKSERVAAARPGLPPEEQHCANCQFMQ
ANVGEGDWKGCQLFPGKLINVNGWCASWTLKAG
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 chain2ams Chain A Residue 84 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
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PDB2ams Geometric factors determine, in part, the electronic state of the 4Fe-4S cluster of Hipip from thermochromtium tepidum: a geomteric, crystallographic, and theoretical study.
Resolution1.4 Å
Binding residue
(original residue number in PDB)		Y19 C43 C46 F48 M49 C61 C75 W78
Binding residue
(residue number reindexed from 1)		Y19 C43 C46 F48 M49 C61 C75 W78
Annotation score4
Enzymatic activity
Enzyme Commision number ?
Gene Ontology
Molecular Function
GO:0009055 electron transfer activity
GO:0046872 metal ion binding
GO:0051539 4 iron, 4 sulfur cluster binding
Biological Process
GO:0019646 aerobic electron transport chain

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Molecular Function
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Biological Process
External links
PDB RCSB:2ams, PDBe:2ams, PDBj:2ams
PDBsum2ams
PubMed
UniProtP80176|HIP_THETI High-potential iron-sulfur protein (Gene Name=hip)

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