Structure of PDB 4ffk Chain A Binding Site BS01

Receptor Information
>4ffk Chain A (length=212) Species: 666510 (Acidilobus saccharovorans 345-15) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
SVVSLKRYELPPLPYNYDALEPIISAETLRYHHDKHHLGYVNGANAALDK
LEKYLNGQLTDIDVRAVSRDFEFNYGGHILHTLYWLNMAPKGKGGGTPGG
AIGDAINKFFGSFDKFKKLFGDAAKNVEGVGWAILAYDPVTGDLRILQVE
KHNNVVTTNLIPLLAVDVFEHAYYIDYRNDRAKYVDSWWDLINWDDVEAR
YQKALNTPKLIL
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 chain4ffk Chain A Residue 301 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
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PDB4ffk X-ray structure of iron superoxide dismutase from Acidilobus saccharovorans
Resolution1.76 Å
Binding residue
(original residue number in PDB)		H43 H92 D178 H182
Binding residue
(residue number reindexed from 1)		H32 H81 D167 H171
Annotation score1
Enzymatic activity
Enzyme Commision number 1.15.1.1: superoxide dismutase.
Gene Ontology
Molecular Function
GO:0004784 superoxide dismutase activity
GO:0016491 oxidoreductase activity
GO:0046872 metal ion binding
Biological Process
GO:0006801 superoxide metabolic process
GO:0019430 removal of superoxide radicals

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Molecular Function
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Biological Process
External links
PDB RCSB:4ffk, PDBe:4ffk, PDBj:4ffk
PDBsum4ffk
PubMed
UniProtD9Q0R7

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