6WBW

Structure of Human HDAC2 in complex with an ethyl ketone inhibitor

6WBW の概要

• エントリーDOI: 10.2210/pdb6wbw/pdb
• 分子名称: Histone deacetylase 2, N-{(1S)-7,7-dihydroxy-1-[5-(2-methoxyquinolin-3-yl)-1H-imidazol-2-yl]nonyl}-1-methylazetidine-3-carboxamide, ZINC ION, ... (6 entities in total)
• 機能のキーワード: histone deacetylase, hydrolase, hydrolase-hydrolase inhibitor complex, hydrolase/hydrolase inhibitor
• 由来する生物種: Homo sapiens (Human)
• タンパク質・核酸の鎖数: 3
• 化学式量合計: 131746.22

構造登録者

Klein, D.J.,Yu, W. (登録日: 2020-03-27, 公開日: 2020-05-06, 最終更新日: 2024-03-06)

• 主引用文献: Yu, W.,Liu, J.,Yu, Y.,Zhang, V.,Clausen, D.,Kelly, J.,Wolkenberg, S.,Beshore, D.,Duffy, J.L.,Chung, C.C.,Myers, R.W.,Klein, D.J.,Fells, J.,Holloway, K.,Wu, J.,Wu, G.,Howell, B.J.,Barnard, R.J.O.,Kozlowski, J.; Discovery of ethyl ketone-based HDACs 1, 2, and 3 selective inhibitors for HIV latency reactivation.; Bioorg.Med.Chem.Lett., 30:127197-127197, 2020; PubMed: 32331932; DOI: 10.1016/j.bmcl.2020.127197

実験手法

X-RAY DIFFRACTION (1.46 Å)