Structure of PDB 2rcv Chain F Binding Site BS01

Receptor Information
>2rcv Chain F (length=200) Species: 1423 (Bacillus subtilis) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
AYELPELPYAYDALEPHIDKETMTIHHTKHHNTYVTNLNKAVEGNTALAN
KSVEELVADLDSVPENIRTAVRNNGGGHANHKLFWTLLSPNGGGEPTGAL
AEEINSVFGSFDKFKEQFAAAAAGRFGSGWAWLVVNNGKLEITSTPNQDS
PLSEGKTPILGLDVWEHAYYLNYQNRRPDYISAFWNVVNWDEVARLYSER
Ligand information
Ligand IDMN
InChIInChI=1S/Mn/q+2
InChIKeyWAEMQWOKJMHJLA-UHFFFAOYSA-N
SMILES
SoftwareSMILES
ACDLabs 10.04
OpenEye OEToolkits 1.5.0		[Mn+2]
CACTVS 3.341[Mn++]
FormulaMn
NameMANGANESE (II) ION
ChEMBL
DrugBankDB06757
ZINC
PDB chain2rcv Chain F Residue 203 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
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PDB2rcv Structure of Bacillus subtilis superoxide dismutase.
Resolution1.6 Å
Binding residue
(original residue number in PDB)		H27 H82 D164 H168
Binding residue
(residue number reindexed from 1)		H26 H81 D163 H167
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
Cellular Component
GO:0005576 extracellular region
GO:0005737 cytoplasm

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Molecular Function
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Biological Process
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Cellular Component
External links
PDB RCSB:2rcv, PDBe:2rcv, PDBj:2rcv
PDBsum2rcv
PubMed18084079
UniProtP54375|SODM_BACSU Superoxide dismutase [Mn] (Gene Name=sodA)

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