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Maganese superoxide dismutase from thermus thermophilus

Analyse Maganese superoxide dismutase from thermus thermophilus in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
3MDS
Type
protein
Length
406 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Manganese superoxide dismutase
EC
1.15.1.1
UniProt
P61503
Ligands
MN3
Pockets
4 · best druggability 0.51

Structure

x-ray diffraction · 1 distinct chain · 57% helix, 10% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
A, BManganese superoxide dismutase (EC 1.15.1.1)protein20357% helix, 10% strandP61503

Ligands and binding sites

  • MN3 · Manganese (III) ion · metal · 2 copies · chains A, B

Binding sites are the residues within 4.5 Å of a ligand's heavy atoms.

Pockets

4 pockets found on a 1 Å grid, 1 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
11730.510.7825empty
21620.490.7722empty
31100.380.7425empty
41170.370.7420empty

Interfaces

1 interface between chains.

  • A–B · 939 Ų buried · 13 hydrogen bonds · protein-protein

Compared structures

  • 3MDS · Maganese superoxide dismutase from thermus thermophilus · the same entry in another collection · chain A against A, TM-score 1.00
  • P61503 · AlphaFold monomer V2.0 prediction for superoxide dismutase [mn] (P61503) · a predicted model of the same protein · chain A against A, TM-score 1.00

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