Crystal structure of the TYK2 pseudokinase domain in complex with compound 11
收藏Protein Data Bank Japan2023-08-23 更新2026-04-25 收录
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Crystal structure of the TYK2 pseudokinase domain in complex with compound 11 Descriptor: (8S)-N-[(1R,2S)-2-fluorocyclopropyl]-5-{[(1M,2'M)-3'-fluoro-2-oxo-2H-[1,2'-bipyridin]-3-yl]amino}-7-(methylamino)pyrazolo[1,5-a]pyrimidine-3-carboxamide, 1,2-ETHANEDIOL, ACETATE ION, ... Authors: Toms, A.V, Leit, S, Greenwood, J.R, Carriero, S, Mondal, S, Abel, R, Ashwell, M, Blanchette, H, Boyles, N, Cartwright, M, Collis, A, Feng, S, Ghanakota, P, Harriman, G.C, Hosagrahara, V, Kaila, N, Kapeller, R, Rafi, S, Romero, D.L, Tarantino, P, Timaniya, J, Wester, R.T, Westlin, W, Srivastava, B, Miao, W, Tummino, P, McElwee, J.J, Edmondson, S.D, Massee, C.E. Deposit date: 2023-03-27 Release date: 2023-07-26 Last modified: 2023-08-23 Method: X-RAY DIFFRACTION (1.71 Å) Cite: Discovery of a Potent and Selective Tyrosine Kinase 2 Inhibitor: TAK-279. J.Med.Chem., 66, 2023
结合化合物11的酪氨酸激酶2(TYK2)假激酶结构域晶体结构
描述符:(8S)-N-[(1R,2S)-2-氟环丙基]-5-{[(1M,2'M)-3'-氟-2-氧代-2H-[1,2'-联吡啶]-3-基]氨基}-7-(甲氨基)吡唑并[1,5-a]嘧啶-3-甲酰胺、1,2-乙二醇、乙酸根离子……
作者:Toms, A.V.、Leit, S.、Greenwood, J.R.、Carriero, S.、Mondal, S.、Abel, R.、Ashwell, M.、Blanchette, H.、Boyles, N.、Cartwright, M.、Collis, A.、Feng, S.、Ghanakota, P.、Harriman, G.C.、Hosagrahara, V.、Kaila, N.、Kapeller, R.、Rafi, S.、Romero, D.L.、Tarantino, P.、Timaniya, J.、Wester, R.T.、Westlin, W.、Srivastava, B.、Miao, W.、Tummino, P.、McElwee, J.J.、Edmondson, S.D.、Massee, C.E.
入库日期:2023年3月27日
发布日期:2023年7月26日
最后修改日期:2023年8月23日
实验方法:X射线衍射(1.71埃)
引用文献:《强效选择性酪氨酸激酶2抑制剂TAK-279的发现》,《药物化学杂志》(J.Med.Chem.),2023年,第66卷
创建时间:
2023-03-27



