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MolNFT v1 · #157402 · protein

Structure of 53BP1 tandem tudor domains in complex with small molecule UNC2991

6MXX: “Structure of 53BP1 tandem tudor domains in complex with small molecule UNC2991”. X-ray diffraction, 2 ligands (K6P, PO4). MolNFT v1 #157402 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB
6MXX
Type
protein
Length
1,196 residues
Chains
10
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
UniProt
Q12888
Ligands
K6P, PO4

Structure

x-ray diffraction · 5 distinct chains.

ChainMoleculeTypeResiduesSecondary structureUniProt
A, D, E, F—protein120—Q12888
B, G, H—protein119—Q12888
C—protein121—Q12888
I—protein118—Q12888
J—protein120—Q12888

Ligands and binding sites

  • K6P · N-[3-(tert-butylamino)propyl]-3-iodobenzamide · ligand · 5 copies · chains A, B, C, D, E, F, G, H, I, J
  • PO4 · Phosphate ion · ion · 21 copies · chains A, B, D, C, E, F, G, H, I, J
  • FMT · Formic acid · additive · 4 copies · chains B, H, G

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

Compared structures

  • 6MXX · Structure of 53BP1 tandem Tudor domains in complex with small molecule UNC2991 · the same entry in another collection · chain J against J, TM-score 1.00
  • Q12888 · AlphaFold monomer V2.0 prediction for TP53-binding protein 1 (Q12888) · a predicted model of the same protein · chain I against A, TM-score 0.95

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