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MolNFT v1 · #66781 · protein

Structure of the S. pombe NBS1 FHA/BRCT-repeat domain

3I0M · DNA repair and telomere maintenance protein NBS1: “Structure of the S. pombe NBS1 FHA/BRCT-repeat domain”. X-ray diffraction, 2 pockets (best druggability 0.33). MolNFT v1 #66781 on GenesisL1: 3D structure, binding sites and pockets…

PDB
3I0M
Type
protein
Length
319 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
DNA repair and telomere maintenance protein NBS1
UniProt
O43070
Pockets
2 · best druggability 0.33

Structure

x-ray diffraction · 1 distinct chain · 30% helix, 23% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
ADNA repair and telomere maintenance protein NBS1protein31930% helix, 23% strandO43070

Ligands and binding sites

  • GOL · Glycerol · additive · chains A

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

Pockets

2 pockets found on a 1 Å grid, 0 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
1550.330.7715empty
2530.290.7618empty

Modifications

Observed in the structure: 8 modified (engineered).

Compared structures

  • 3I0M · Structure of the S. pombe Nbs1 FHA/BRCT-repeat domain · the same entry in another collection · chain A against A, TM-score 1.00
  • O43070 · AlphaFold monomer V2.0 prediction for DNA repair and telomere maintenance protein NBS1… · a predicted model of the same protein · chain A against A, TM-score 0.95

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