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MolNFT v2 · #157891 · protein

CRYSTAL STRUCTURE OF THE FIRST BROMODOMAIN OF HUMAN BRD4 IN COMPLEX WITH HU-10, A 1,4,5-Trisubstituted Imidazole Analogue

6MH1: “CRYSTAL STRUCTURE OF THE FIRST BROMODOMAIN OF HUMAN BRD4 IN COMPLEX WITH HU-10, A 1,4,5-Trisubstituted…”. X-ray diffraction at 1.6, 1 ligand (JQP). MolNFT v2 #157891 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB
6MH1
Type
protein
Length
254 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v2 / PDB Bank
Contract
0xd58B01f6C18086e5202cdC5D7Ad3E41790360102
Owner
0xF4e1AA6f26B7DA48EeAD9B24a97927303eeA07b8
Resolution
1.6
Source
Homo sapiens
UniProt
O60885
Ligands
JQP

Structure

x-ray diffraction · resolution 1.6 · 1 distinct chain.

ChainMoleculeTypeResiduesSecondary structureUniProt
A, B—protein127—O60885

Ligands and binding sites

  • JQP · N-(3,5-dimethylphenyl)-4-[4-(4-fluorophenyl)-1-(piperidin-4-yl)-1H-imidazol-5-yl]pyrimidin-2-amine · ligand · 2 copies · chains A, B
  • EDO · 1,2-ethanediol · additive · 3 copies · chains A, B

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

Compared structures

  • 6MH1 · Crystal structure of the first bromodomain of human BRD4 in complex with hu-10, a… · 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 0.98

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