7LAY

Crystal structure of the first bromodomain (BD1) of human BRD3 bound to SG3-179

Summary for 7LAY

• Entry DOI: 10.2210/pdb7lay/pdb
• Descriptor: Bromodomain-containing protein 3, 4-[[4-[[3-(~{tert}-butylsulfonylamino)-4-chloranyl-phenyl]amino]-5-methyl-pyrimidin-2-yl]amino]-2-fluoranyl-~{N}-(1-methylpiperidin-4-yl)benzamide, 1,2-ETHANEDIOL, ... (5 entities in total)
• Functional Keywords: bet, erk5, dual brd-kinase inhibitor, gene regulation, gene regulation-inhibitor complex, gene regulation/inhibitor
• Biological source: Homo sapiens (Human)
• Total number of polymer chains: 2
• Total formula weight: 30600.30

Authors

Karim, M.R.,Bikowitz, M.J.,Schonbrunn, E. (deposition date: 2021-01-07, release date: 2021-07-14, Last modification date: 2023-10-18)

• Primary citation: Karim, R.M.,Bikowitz, M.J.,Chan, A.,Zhu, J.Y.,Grassie, D.,Becker, A.,Berndt, N.,Gunawan, S.,Lawrence, N.J.,Schonbrunn, E.; Differential BET Bromodomain Inhibition by Dihydropteridinone and Pyrimidodiazepinone Kinase Inhibitors.; J.Med.Chem., 64:15772-15786, 2021; PubMed: 34710325; DOI: 10.1021/acs.jmedchem.1c01096

Experimental method

X-RAY DIFFRACTION (1.45 Å)