Structure of PDB 1f37 Chain B Binding Site BS01

Receptor Information
>1f37 Chain B (length=110) Species: 63363 (Aquifex aeolicus) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
AEFKHVFVCVQDRPPGHPQGSCAQRGSREVFQAFMEKIQTDPQLFMTTVI
TPTGCMNACMMGPVVVVYPDGVWYGQVKPEDVDEIVEKHLKGGEPVERLV
ISKGKPPGMF
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 chain1f37 Chain B Residue 1002 [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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PDB1f37 Structure of a thioredoxin-like [2Fe-2S] ferredoxin from Aquifex aeolicus.
Resolution2.3 Å
Binding residue
(original residue number in PDB)
C9 Q11 R13 C22 C55 C59
Binding residue
(residue number reindexed from 1)
C9 Q11 R13 C22 C55 C59
Annotation score4
Enzymatic activity
Enzyme Commision number ?
Gene Ontology
Molecular Function
GO:0046872 metal ion binding
GO:0051537 2 iron, 2 sulfur cluster binding

View graph for
Molecular Function
External links
PDB RCSB:1f37, PDBe:1f37, PDBj:1f37
PDBsum1f37
PubMed10884354
UniProtO66511|FER2_AQUAE Ferredoxin, 2Fe-2S (Gene Name=fdx4)

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