GL1X · GenesisL1 explorer

MolNFT v2 · #155556 · protein

Crystal structure of BRD4 Bromodomain1 with an inhibitor

6KEE: “Crystal structure of BRD4 Bromodomain1 with an inhibitor”. X-ray diffraction at 2.12155, 1 ligand (D7U). MolNFT v2 #155556 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB
6KEE
Type
protein
Length
127 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v2 / PDB Bank
Contract
0xd58B01f6C18086e5202cdC5D7Ad3E41790360102
Owner
0xF4e1AA6f26B7DA48EeAD9B24a97927303eeA07b8
Resolution
2.12155
Source
Homo sapiens
UniProt
O60885
Ligands
D7U

Structure

x-ray diffraction · resolution 2.12155 · 1 distinct chain.

ChainMoleculeTypeResiduesSecondary structureUniProt
A—protein127—O60885

Ligands and binding sites

  • D7U · 6-[2-[2,4-bis(fluoranyl)phenoxy]-5-(methylsulfonylmethyl)pyridin-3-yl]-8-methyl-2H-pyrrolo[1,2-a]pyrazin-1-one · ligand · chains A

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

Compared structures

  • 6KEE · Crystal structure of BRD4 BROMODOMAIN1 with an inhibitor · 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 0.96

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