3NS9

Crystal structure of CDK2 in complex with inhibitor BS-194

3NS9 の概要

• エントリーDOI: 10.2210/pdb3ns9/pdb
• 分子名称: Cell division protein kinase 2, (2S,3S)-3-{[7-(benzylamino)-3-(1-methylethyl)pyrazolo[1,5-a]pyrimidin-5-yl]amino}butane-1,2,4-triol (3 entities in total)
• 機能のキーワード: protein kinase, transferase-transferase inhibitor complex, transferase/transferase 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: 34361.95

構造登録者

Hazel, P.,Freemont, P.S. (登録日: 2010-07-01, 公開日: 2010-12-08, 最終更新日: 2023-09-06)

• 主引用文献: Heathcote, D.A.,Patel, H.,Kroll, S.H.,Hazel, P.,Periyasamy, M.,Alikian, M.,Kanneganti, S.K.,Jogalekar, A.S.,Scheiper, B.,Barbazanges, M.,Blum, A.,Brackow, J.,Siwicka, A.,Pace, R.D.,Fuchter, M.J.,Snyder, J.P.,Liotta, D.C.,Freemont, P.S.,Aboagye, E.O.,Coombes, R.C.,Barrett, A.G.,Ali, S.; A Novel Pyrazolo[1,5-a]pyrimidine Is a Potent Inhibitor of Cyclin-Dependent Protein Kinases 1, 2, and 9, Which Demonstrates Antitumor Effects in Human Tumor Xenografts Following Oral Administration.; J.Med.Chem., 53:8508-8522, 2010; PubMed: 21080703; DOI: 10.1021/jm100732t

実験手法

X-RAY DIFFRACTION (1.78 Å)