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MolNFT v1 · #74318 · protein

Escherichia COLI apo-manganese superoxide dismutase

3OT7 · Superoxide dismutase [mn]: “Escherichia COLI apo-manganese superoxide dismutase”. X-ray diffraction, 8 pockets (best druggability 0.55). MolNFT v1 #74318 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB
3OT7
Type
protein
Length
820 residues
Chains
4
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Superoxide dismutase [mn]
EC
1.15.1.1
UniProt
P00448
Pockets
8 · best druggability 0.55

Structure

x-ray diffraction · 1 distinct chain · 55% helix, 12% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
A, B, C, DSuperoxide dismutase [mn] (EC 1.15.1.1)protein20555% helix, 12% strandP00448

Pockets

8 pockets found on a 1 Å grid, 5 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
13970.550.7437empty
23210.550.7548empty
31570.510.7920empty
41500.510.7920empty
51690.510.7818empty

Interfaces

4 interfaces between chains.

  • C–D · 916 Ų buried · 12 hydrogen bonds · protein-protein
  • A–B · 902 Ų buried · 11 hydrogen bonds · protein-protein
  • A–D · 369 Ų buried · 4 hydrogen bonds · protein-protein
  • A–C · 63 Ų buried · 0 hydrogen bonds · protein-protein

Compared structures

  • 3OT7 · Escherichia coli apo-manganese superoxide dismutase · the same entry in another collection · chain A against A, TM-score 1.00
  • P00448 · AlphaFold monomer V2.0 prediction for superoxide dismutase [mn] (P00448) · a predicted model of the same protein · chain A against A, TM-score 0.99

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