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MolNFT v1 · #131978 · protein

Pandda analysis group deposition of models with modelled events (E.G. bound ligands) -- crystal structure of NUDT5 in complex with Z1270312110

5QK0: “Pandda analysis group deposition of models with modelled events (E.G. bound ligands) -- crystal structure of…”. X-ray diffraction, 3 ligands (K31, MG, CL). MolNFT v1 #131978 on GenesisL1: 3D structure, binding sites and pockets in…

PDB
5QK0
Type
protein
Length
770 residues
Chains
4
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
UniProt
Q9UKK9
Ligands
K31, MG, CL

Structure

x-ray diffraction · 4 distinct chains.

ChainMoleculeTypeResiduesSecondary structureUniProt
A—protein194—Q9UKK9
B—protein194—Q9UKK9
C—protein192—Q9UKK9
D—protein190—Q9UKK9

Ligands and binding sites

  • K31 · 2-(3,5-dimethyl-1H-pyrazol-4-yl)aniline · ligand · 2 copies · chains A, B
  • MG · Magnesium ion · metal · 8 copies · chains A, B, C, D
  • CL · Chloride ion · ion · chains B
  • EDO · 1,2-ethanediol · additive · 4 copies · chains A, B, C

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

Compared structures

  • 5QK0 · PanDDA analysis group deposition of models with modelled events (e.g. bound ligands)… · the same entry in another collection · chain A against A, TM-score 1.00

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