Structure of PDB 5x2j Chain A Binding Site BS01

Receptor Information
>5x2j Chain A (length=199) Species: 246432 (Staphylococcus equorum) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
MAFELPNLPYGFRALEPHIDQQTMEIHHDKHHNTYVTKLNAAVEGTDLES
KSIEEIVANLDSVPENIQTAVRNNGGGHLNHSLFWELLTPNSEEKGTVVD
KIKEQWGSLDAFKEEFANQAAARFGSGWAWLVVNDGKLEIVTTPNQDNPL
TEGKTPILGLDVWEHAYYLKYQNKRPDYISAFWNVVNWEKVDELYNAAK
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 chain5x2j Chain A Residue 201 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
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PDB5x2j The first crystal structure of manganese superoxide dismutase from the genus Staphylococcus
Resolution1.4 Å
Binding residue
(original residue number in PDB)		H27 H81 D161 H165
Binding residue
(residue number reindexed from 1)		H27 H81 D161 H165
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:5x2j, PDBe:5x2j, PDBj:5x2j
PDBsum5x2j
PubMed29497016
UniProtA0A1E5TT85

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