7LH8

CRYSTAL STRUCTURE OF THE FIRST BROMODOMAIN OF HUMAN BRD4 IN COMPLEX WITH INHIBITOR JJ-II-131

7LH8 の概要

• エントリーDOI: 10.2210/pdb7lh8/pdb
• 分子名称: Bromodomain-containing protein 4, (5R)-1-ethyl-5-(4-methylphenyl)-7-({1-[(4-nitrophenyl)methyl]piperidin-4-yl}methyl)-5,7,8,9-tetrahydro-1H-pyrrolo[3',4':5,6]pyrido[2,3-d]pyrimidine-2,4,6(3H)-trione, 1,2-ETHANEDIOL, ... (5 entities in total)
• 機能のキーワード: small molecule inhibitor, drug discovery, epigenetics, transcription, transcription-inhibitor complex, 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: 16065.42

構造登録者

Schonbrunn, E.,Chan, A. (登録日: 2021-01-21, 公開日: 2022-07-06, 最終更新日: 2023-10-25)

• 主引用文献: Jiang, J.,Sigua, L.H.,Chan, A.,Kalra, P.,Pomerantz, W.C.K.,Schonbrunn, E.,Qi, J.,Georg, G.I.; Dihydropyridine Lactam Analogs Targeting BET Bromodomains.; Chemmedchem, 17:e202100407-e202100407, 2022; PubMed: 34932262; DOI: 10.1002/cmdc.202100407

実験手法

X-RAY DIFFRACTION (1.75 Å)