6UWU

Crystal Structure of the first bromodomain of human BRD4 in complex with the inhibitor ZL0516

Summary for 6UWU

Entry DOI	10.2210/pdb6uwu/pdb
Descriptor	Bromodomain-containing protein 4, 1,2-ETHANEDIOL, 2-{4-[(2R)-2-hydroxy-3-(4-methylpiperazin-1-yl)propoxy]-3,5-dimethylphenyl}-5,7-dimethoxy-4H-1-benzopyran-4-one, ... (4 entities in total)
Functional Keywords	bromodomain, inhibitor, complex, gene regulation, transcription
Biological source	Homo sapiens (Human)
Total number of polymer chains	1
Total formula weight	15892.29
Authors	Leonard, P.G.,Joseph, S. (deposition date: 2019-11-05, release date: 2020-04-15, Last modification date: 2023-10-11)
Primary citation	Liu, Z.,Chen, H.,Wang, P.,Li, Y.,Wold, E.A.,Leonard, P.G.,Joseph, S.,Brasier, A.R.,Tian, B.,Zhou, J. Discovery of Orally Bioavailable Chromone Derivatives as Potent and Selective BRD4 Inhibitors: Scaffold Hopping, Optimization, and Pharmacological Evaluation. J.Med.Chem., 63:5242-5256, 2020 Cited by PubMed: 32255647 DOI: 10.1021/acs.jmedchem.0c00035 PDB entries with the same primary citation
Experimental method	X-RAY DIFFRACTION (2 Å)

Structure validation