4M84

Calcium-Dependent Protein Kinase 1 from Toxoplasma gondii (TgCDPK1) in complex with inhibitor UW1455

4M84 の概要

• エントリーDOI: 10.2210/pdb4m84/pdb
• 分子名称: Calmodulin-domain protein kinase 1, 5-amino-1-tert-butyl-3-(quinolin-2-yl)-1H-pyrazole-4-carboxamide (3 entities in total)
• 機能のキーワード: serine/threonine protein kinase, transferase, calcium-binding, atp-binding, bumped kinase inhibitor, transferase-transferase inhibitor complex, transferase/transferase inhibitor
• 由来する生物種: Toxoplasma gondii
• タンパク質・核酸の鎖数: 1
• 化学式量合計: 55536.28

構造登録者

Merritt, E.A. (登録日: 2013-08-12, 公開日: 2013-10-02, 最終更新日: 2023-09-20)

• 主引用文献: Zhang, Z.,Ojo, K.K.,Vidadala, R.,Huang, W.,Geiger, J.A.,Scheele, S.,Choi, R.,Reid, M.C.,Keyloun, K.R.,Rivas, K.,Siddaramaiah, L.K.,Comess, K.M.,Robinson, K.P.,Merta, P.J.,Kifle, L.,Hol, W.G.,Parsons, M.,Merritt, E.A.,Maly, D.J.,Verlinde, C.L.,Van Voorhis, W.C.,Fan, E.; Potent and selective inhibitors of CDPK1 from T. gondii and C. parvum based on a 5-aminopyrazole-4-carboxamide scaffold.; ACS Med Chem Lett, 5:40-44, 2014; PubMed: 24494061; DOI: 10.1021/ml400315s

実験手法

X-RAY DIFFRACTION (1.998 Å)