GL1X · GenesisL1 explorer

MolNFT v2 · #143800 · protein

Crystal structure of BRD4 in complex with isoliquiritigenin and DMSO (Cocktail No. 3)

6AJV: “Crystal structure of BRD4 in complex with isoliquiritigenin and DMSO (Cocktail No. 3)”. X-ray diffraction at 1.45, 2 ligands (HCC, NA). MolNFT v2 #143800 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB
6AJV
Type
protein
Length
133 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v2 / PDB Bank
Contract
0xd58B01f6C18086e5202cdC5D7Ad3E41790360102
Owner
0xF4e1AA6f26B7DA48EeAD9B24a97927303eeA07b8
Resolution
1.45
Source
Homo sapiens
UniProt
O60885
Ligands
HCC, NA

Structure

x-ray diffraction · resolution 1.45 · 1 distinct chain.

ChainMoleculeTypeResiduesSecondary structureUniProt
A—protein133—O60885

Ligands and binding sites

  • HCC · 2',4,4'-trihydroxychalcone · ligand · chains A
  • NA · Sodium ion · metal · 3 copies · chains A
  • DMS · Dimethyl sulfoxide · additive · chains A

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

Compared structures

  • 6AJV · Crystal structure of BRD4 in complex with isoliquiritigenin and dmso (cocktail no. 3) · 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 0.92

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