Crystal structure of ITK in complex with compound 52

Crystal structure of ITK in complex with compound 52 Descriptor: 3-{1-[(3R)-1-acryloylpiperidin-3-yl]-4-amino-1H-pyrazolo[3,4-d]pyrimidin-3-yl}-N-(3-tert-butylphenyl)benzamide, Tyrosine-protein kinase ITK/TSK Authors: Zapf, C.W, Gerstenberger, B.S, Xing, L, Limburg, D.C, Anderson, D.R, Caspers, N, Han, S, Aulabaugh, A, Kurumbail, R, Shakya, S, Li, X, Spaulding, V, Czerwinski, R.M, Seth, N, Medley, Q.G. Deposit date: 2012-10-01 Release date: 2012-11-14 Last modified: 2024-02-28 Method: X-RAY DIFFRACTION (1.48 Å) Cite: Covalent inhibitors of interleukin-2 inducible T cell kinase (itk) with nanomolar potency in a whole-blood assay. J.Med.Chem., 55, 2012白细胞介素-2诱导型T细胞激酶（ITK）与化合物52复合物的晶体结构 配体描述：3-{1-[(3R)-1-丙烯酰基哌啶-3-基]-4-氨基-1H-吡唑并[3,4-d]嘧啶-3-基}-N-(3-叔丁基苯基)苯甲酰胺 靶蛋白：酪氨酸蛋白激酶ITK/TSK 作者：Zapf, C.W、Gerstenberger, B.S、Xing, L、Limburg, D.C、Anderson, D.R、Caspers, N、Han, S、Aulabaugh, A、Kurumbail, R、Shakya, S、Li, X、Spaulding, V、Czerwinski, R.M、Seth, N、Medley, Q.G. 存储日期：2012-10-01 发布日期：2012-11-14 最后修改日期：2024-02-28 检测方法：X射线衍射（1.48 Å） 引用文献：全血检测中具有纳摩尔级活性的白细胞介素-2诱导型T细胞激酶（ITK）共价抑制剂。J. Med. Chem., 55, 2012