9C1R

Crystal structure of mutant cMET D1228N kinase domain in complex with inhibitor compound 13

これはPDB形式変換不可エントリーです。

9C1R の概要

• エントリーDOI: 10.2210/pdb9c1r/pdb
• 分子名称: Hepatocyte growth factor receptor, GLYCEROL, N-(2,5-difluoro-4-{[(1s,3S)-3-(1-methyl-1H-pyrazol-3-yl)cyclobutyl][(8R)-pyrazolo[1,5-a]pyrazin-4-yl]amino}phenyl)-2-(5-fluoropyridin-2-yl)-3-oxo-2,3-dihydropyridazine-4-carboxamide, ... (4 entities in total)
• 機能のキーワード: cmet kinase domain, signaling protein
• 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: 35650.13

構造登録者

Simpson, H.,Wu, W.-I.,Mou, T.-C. (登録日: 2024-05-29, 公開日: 2024-08-21, 最終更新日: 2024-09-04)

• 主引用文献: Bumpers, Q.A.,Pipal, R.W.,Benz-Weeden, A.M.,Brewster 2nd, J.T.,Cook, A.,Crooks, A.L.,Cruz, C.,Dwulet, N.C.,Gaudino, J.J.,Golec, D.,Harrison, J.A.,Hartley, D.P.,Hassanien, S.H.,Hicken, E.J.,Kahn, D.,Laird, E.R.,Lemieux, C.,Lewandowski, N.,McCown, J.,McDonald, M.G.,McNulty, O.,Mou, T.C.,Nguyen, P.,Oko, L.,Opie, L.P.,Otten, J.,Peck, S.C.,Polites, V.C.,Randall, S.D.,Rosen, R.Z.,Savechenkov, P.,Simpson, H.,Singh, A.,Sparks, D.,Wickersham, K.,Wollenberg, L.,Wong, C.E.,Wong, J.,Wu, W.I.,Elsayed, M.S.A.,Hinklin, R.J.,Tang, T.P.; Discovery of Pyrazolopyrazines as Selective, Potent, and Mutant-Active MET Inhibitors with Intracranial Efficacy.; J.Med.Chem., 67:14466-14477, 2024; PubMed: 39088797; DOI: 10.1021/acs.jmedchem.4c01232

実験手法

X-RAY DIFFRACTION (1.59 Å)