6C7R

BRD4 BD1 in complex with compound CF53

6C7R の概要

• エントリーDOI: 10.2210/pdb6c7r/pdb
• 分子名称: Bromodomain-containing protein 4, N-(3-cyclopropyl-1-methyl-1H-pyrazol-5-yl)-7-(3,5-dimethyl-1,2-oxazol-4-yl)-6-methoxy-2-methyl-9H-pyrimido[4,5-b]indol-4-amine (3 entities in total)
• 機能のキーワード: bromodomain, transcription, transcription-transcription inhibitor complex, transcription/transcription inhibitor
• 由来する生物種: Homo sapiens (Human)
• タンパク質・核酸の鎖数: 1
• 化学式量合計: 15237.53

構造登録者

Meagher, J.L.,Stuckey, J.A. (登録日: 2018-01-23, 公開日: 2018-08-01, 最終更新日: 2023-10-04)

• 主引用文献: Zhao, Y.,Zhou, B.,Bai, L.,Liu, L.,Yang, C.Y.,Meagher, J.L.,Stuckey, J.A.,McEachern, D.,Przybranowski, S.,Wang, M.,Ran, X.,Aguilar, A.,Hu, Y.,Kampf, J.W.,Li, X.,Zhao, T.,Li, S.,Wen, B.,Sun, D.,Wang, S.; Structure-Based Discovery of CF53 as a Potent and Orally Bioavailable Bromodomain and Extra-Terminal (BET) Bromodomain Inhibitor.; J. Med. Chem., 61:6110-6120, 2018; PubMed: 30015487; DOI: 10.1021/acs.jmedchem.8b00483

実験手法

X-RAY DIFFRACTION (1.5 Å)