Structure of PDB 3mps Chain F Binding Site BS02

Receptor Information
>3mps Chain F (length=170) Species: 2261 (Pyrococcus furiosus) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
VVKRTMTKKFLEEAFAGESMAHMRYLIFAEKAEQEGFPNIAKLFRAIAYA
EFVHAKNHFIALGKLGKTPENLQMGIEGETFEVEEMYPVYNKAAEFQGEK
EAVRTTHYALEAEKIHAELYRKAKEKAEKGEDIEIKKVYICPICGYTAVD
EAPEYCPVCGAPKEKFVVFE
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 chain3mps Chain F Residue 172 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
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PDB3mps A cryo-crystallographic time course for peroxide reduction by rubrerythrin from Pyrococcus furiosus.
Resolution2.0 Å
Binding residue
(original residue number in PDB)
C142 I144 C145 C157 C160
Binding residue
(residue number reindexed from 1)
C141 I143 C144 C156 C159
Annotation score4
Enzymatic activity
Enzyme Commision number ?
Gene Ontology
Molecular Function
GO:0005506 iron ion binding
GO:0016491 oxidoreductase activity
GO:0046872 metal ion binding

View graph for
Molecular Function
External links
PDB RCSB:3mps, PDBe:3mps, PDBj:3mps
PDBsum3mps
PubMed21647777
UniProtQ9UWP7

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