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MolNFT v1 · #173583 · protein + DNA

Structural basis of reactivation of oncogenic P53 mutants by a small molecule: methylene quinuclidinone (mq). human P53DBD-R273C/S240R double mutant bound to DNA and mq: R273C/S240R-DNA-mq

7B4D: “Structural basis of reactivation of oncogenic P53 mutants by a small molecule: methylene quinuclidinone (mq).…”. X-ray diffraction, 3 ligands (QNN, QN8, ZN). MolNFT v1 #173583 on GenesisL1: 3D structure, binding sites and pockets in…

PDB
7B4D
Type
protein + DNA
Length
208 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
UniProt
P04637
Ligands
QNN, QN8, ZN

Structure

x-ray diffraction · 2 distinct chains.

ChainMoleculeTypeResiduesSecondary structureUniProt
A—protein197—P04637
C—dna11——

Ligands and binding sites

  • QNN · (2~{S})-2-methyl-1-azabicyclo[2.2.2]octan-3-one · ligand · 3 copies · chains A, C
  • QN8 · (2~{R})-2-methyl-1-azabicyclo[2.2.2]octan-3-one · ligand · chains A
  • ZN · Zinc ion · metal · chains A
  • FMT · Formic acid · additive · 3 copies · chains A

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

Compared structures

  • 7B4D · Structural basis of reactivation of oncogenic p53 mutants by a small molecule: methylene… · the same entry in another collection · chain A against A, TM-score 1.00

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