Structure of PDB 7w6w Chain D Binding Site BS02

Receptor Information
>7w6w Chain D (length=197) Species: 246432 (Staphylococcus equorum) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
AFELPNLPYGFRALEPHIDQQTMEIHHDKHHNTYVTKLNAAVEGTDLESK
SIEEIVANLDSVPENIQTAVRNNGGGHLNHSLFWELLTPNSEEKGTVVDK
IKEQWGSLDAFKEEFANQAAARFGSGWAWLVVNDGKLEIVTTPNQDNPLT
EGKTPILGLDVWEHAYYWKYQNKRPDYISAFWNVVNWEKVDELYNAA
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 chain7w6w Chain D Residue 302 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
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PDB7w6w Introducing Intermolecular Interaction to Strengthen the Stability of MnSOD Dimer.
Resolution1.94 Å
Binding residue
(original residue number in PDB)		H27 H81 D161 H165
Binding residue
(residue number reindexed from 1)		H26 H80 D160 H164
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:7w6w, PDBe:7w6w, PDBj:7w6w
PDBsum7w6w
PubMed36701098
UniProtA0A1E5TT85

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