6WW8

BRD4 Bromodomain 1 in complex with triple CDK4/6-PI3K-BET inhibitor

Summary for 6WW8

Entry DOI	10.2210/pdb6ww8/pdb
Descriptor	Bromodomain-containing protein 4, 7-cyclopentyl-N,N-dimethyl-2-({4-[5-(morpholin-4-yl)-7-oxo-7H-thieno[3,2-b]pyran-3-yl]phenyl}amino)-7H-pyrrolo[2,3-d]pyrimidine-6-carboxamide (3 entities in total)
Functional Keywords	bet, cdk4/6, pi3-kinase, triple-action, transcription
Biological source	Homo sapiens (Human)
Total number of polymer chains	1
Total formula weight	16853.44
Authors	Vann, K.R.,Kutateladze, T.G. (deposition date: 2020-05-08, release date: 2020-08-26, Last modification date: 2023-10-18)
Primary citation	Burgoyne, A.M.,Vann, K.R.,Joshi, S.,Morales, G.A.,Vega, F.M.,Singh, A.,Pal, D.,Merati, A.B.,Kutateladze, T.G.,Durden, D.L. A triple action CDK4/6-PI3K-BET inhibitor with augmented cancer cell cytotoxicity. Cell Discov, 6:49-49, 2020 Cited by PubMed: 32793389 DOI: 10.1038/s41421-020-0181-z PDB entries with the same primary citation
Experimental method	X-RAY DIFFRACTION (2.302 Å)

Structure validation