4J0S

Crystal Structure of the first bromodomain of human BRD4 in complex with a 3,5-dimethylisoxazol ligand

4J0S の概要

• エントリーDOI: 10.2210/pdb4j0s/pdb
• 関連するPDBエントリー: 4J0R
• 分子名称: Bromodomain-containing protein 4, 1,2-ETHANEDIOL, 3-(3,5-dimethyl-1,2-oxazol-4-yl)-5-[(S)-hydroxy(phenyl)methyl]phenol, ... (4 entities in total)
• 機能のキーワード: brd4, bromodomain containing protein 4, cap, hunk1, mcap, mitotic chromosome associated protein, isoxazole, structural genomics consortium, sgc, signaling protein
• 由来する生物種: Homo sapiens (human)
• 細胞内の位置: Nucleus (By similarity): O60885
• タンパク質・核酸の鎖数: 1
• 化学式量合計: 15642.98

構造登録者

Filippakopoulos, P.,Picaud, S.,Qi, J.,Felletar, I.,Hewings, D.S.,von Delft, F.,Conway, S.J.,Bountra, C.,Arrowsmith, C.H.,Edwards, A.,Knapp, S.,Structural Genomics Consortium (SGC) (登録日: 2013-01-31, 公開日: 2013-02-13, 最終更新日: 2023-09-20)

• 主引用文献: Hewings, D.S.,Fedorov, O.,Filippakopoulos, P.,Martin, S.,Picaud, S.,Tumber, A.,Wells, C.,Olcina, M.M.,Freeman, K.,Gill, A.,Ritchie, A.J.,Sheppard, D.W.,Russell, A.J.,Hammond, E.M.,Knapp, S.,Brennan, P.E.,Conway, S.J.; Optimization of 3,5-dimethylisoxazole derivatives as potent bromodomain ligands.; J.Med.Chem., 56:3217-3227, 2013; PubMed: 23517011; DOI: 10.1021/jm301588r

実験手法

X-RAY DIFFRACTION (1.84 Å)