7EIL

BRD4-BD1 in complex with LT-909-110

Summary for 7EIL

• Entry DOI: 10.2210/pdb7eil/pdb
• Descriptor: Bromodomain-containing protein 4, N-[4-[4-ethanoyl-5-methyl-2-[6-(4-methylpiperazin-1-yl)-1H-benzimidazol-2-yl]-1H-pyrrol-3-yl]phenyl]ethanamide (3 entities in total)
• Functional Keywords: inhibitor, brd4, bd1, gene regulation
• Biological source: Homo sapiens (Human)
• Total number of polymer chains: 1
• Total formula weight: 15353.75

Authors

Zheng, W.,Kong, B.,Tang, W.,Zhu, J.,Chen, Y. (deposition date: 2021-03-31, release date: 2022-04-06, Last modification date: 2023-11-29)

• Primary citation: Kong, B.,Zhu, Z.,Li, H.,Hong, Q.,Wang, C.,Ma, Y.,Zheng, W.,Jiang, F.,Zhang, Z.,Ran, T.,Bian, Y.,Yang, N.,Lu, T.,Zhu, J.,Tang, W.,Chen, Y.; Discovery of 1-(5-(1H-benzo[d]imidazole-2-yl)-2,4-dimethyl-1H-pyrrol-3-yl)ethan-1-one derivatives as novel and potent bromodomain and extra-terminal (BET) inhibitors with anticancer efficacy; Eur.J.Med.Chem., 227:113953-, 2022; DOI: 10.1016/j.ejmech.2021.113953

Experimental method

X-RAY DIFFRACTION (1.7 Å)