6U0D

Crystal Structure of the first bromodomain of human BRD4 in complex with the inhibitor ZL0590

Summary for 6U0D

Entry DOI	10.2210/pdb6u0d/pdb
Descriptor	Bromodomain-containing protein 4, DIMETHYL SULFOXIDE, N-[4-({(2S)-2-[(morpholin-4-yl)methyl]pyrrolidin-1-yl}sulfonyl)phenyl]-N'-[4-(trifluoromethyl)phenyl]urea, ... (4 entities in total)
Functional Keywords	bromodomain, inhibitor, complex, gene regulation
Biological source	Homo sapiens (human)
Total number of polymer chains	1
Total formula weight	15690.06
Authors	Leonard, P.G.,Joseph, S. (deposition date: 2019-08-14, release date: 2020-08-19, Last modification date: 2023-10-11)
Primary citation	Liu, Z.,Li, Y.,Chen, H.,Lai, H.,Wang, P.,Wu, S.,Wold, E.A.,Leonard, P.G.,Joseph, S.,Hu, H.,Chiang, C.,Brasier, A.R.,Tian, B.,Zhou, J. Discovery, X-ray Crystallography, and Anti-inflammatory Activity of Bromodomain-containing Protein 4 (BRD4) BD1 Inhibitors Targeting a Distinct New Binding Site J. Med. Chem., 2022 Cited by DOI: 10.1021/acs.jmedchem.1c01851 PDB entries with the same primary citation
Experimental method	X-RAY DIFFRACTION (1.43 Å)

Structure validation