GL1X · GenesisL1 explorer

MolNFT v1 · #152116 · protein

Crystal structure of the first bromodomain of BRD4 in complex with RT53

6I7X: “Crystal structure of the first bromodomain of BRD4 in complex with RT53”. X-ray diffraction, 1 ligand (H7B). MolNFT v1 #152116 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB
6I7X
Type
protein
Length
127 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
UniProt
O60885
Ligands
H7B

Structure

x-ray diffraction · 1 distinct chain.

ChainMoleculeTypeResiduesSecondary structureUniProt
A—protein127—O60885

Ligands and binding sites

  • H7B · 2-[(4~{S})-6-(4-chlorophenyl)-8-methoxy-1-methyl-4~{H}-[1,2,4]triazolo[4,3-a][1,4]benzodiazepin-4-yl]-1-[4-(dimethylamino)piperidin-1-yl]ethanone · ligand · chains A
  • EDO · 1,2-ethanediol · additive · 3 copies · chains A

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

Compared structures

  • 6I7X · Crystal Structure of the first bromodomain of BRD4 in complex with RT53 · the same entry in another collection · chain A against A, TM-score 1.00
  • O60885 · AlphaFold monomer V2.0 prediction for bromodomain-containing protein 4 (O60885) · a predicted model of the same protein · chain A against A, TM-score 0.97

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