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MolNFT v1 · #128548 · protein

Crystal structure of the human bromodomain of EP300 bound to the inhibitor xdm-cbp

5NU5: “Crystal structure of the human bromodomain of EP300 bound to the inhibitor xdm-cbp”. X-ray diffraction, 1 ligand (99E). MolNFT v1 #128548 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB
5NU5
Type
protein
Length
232 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
UniProt
Q09472
Ligands
99E

Structure

x-ray diffraction · 1 distinct chain.

ChainMoleculeTypeResiduesSecondary structureUniProt
A, B—protein116—Q09472

Ligands and binding sites

  • 99E · ~{N}-[[2,8-bis(oxidanyl)naphthalen-1-yl]methyl]-4-ethanoyl-3-ethyl-5-methyl-1~{H}-pyrrole-2-carboxamide · ligand · 2 copies · chains A, B
  • EDO · 1,2-ethanediol · additive · 5 copies · chains A, B

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

Compared structures

  • 5NU5 · Crystal structure of the human bromodomain of EP300 bound to the inhibitor XDM-CBP · the same entry in another collection · chain A against A, TM-score 1.00
  • Q09472 · AlphaFold monomer V2.0 prediction for histone acetyltransferase P300 (Q09472) · a predicted model of the same protein · chain A against A, TM-score 0.99

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