Crystal structure of human Casein Kinase II subunit alpha (CK2a1) in complex with 5-((4-((2-aminoethyl)(ethyl)amino)-3-(4H-1,2,4-triazol-4-yl)phenyl)amino)-7-(cyclopropylamino)pyrazolo[1,5-a]pyrimidine-3-carbonitrile

Crystal structure of human Casein Kinase II subunit alpha (CK2a1) in complex with 5-((4-((2-aminoethyl)(ethyl)amino)-3-(4H-1,2,4-triazol-4-yl)phenyl)amino)-7-(cyclopropylamino)pyrazolo[1,5-a]pyrimidine-3-carbonitrile Descriptor: 1,2-ETHANEDIOL, 5-[[4-[2-azanylethyl(ethyl)amino]-3-(1,2,4-triazol-4-yl)phenyl]amino]-7-(cyclopropylamino)pyrazolo[1,5-a]pyrimidine-3-carbonitrile, Casein kinase II subunit alpha, ... Authors: Kraemer, A, Ong, H.W, Yang, X, Brown, J.W, Chang, E, Willson, T, Knapp, S, Structural Genomics Consortium (SGC) Deposit date: 2024-04-12 Release date: 2024-07-31 Last modified: 2024-08-07 Method: X-RAY DIFFRACTION (2.18 Å) Cite: More than an Amide Bioisostere: Discovery of 1,2,4-Triazole-containing Pyrazolo[1,5- a ]pyrimidine Host CSNK2 Inhibitors for Combatting beta-Coronavirus Replication. J.Med.Chem., 67, 2024

人源酪蛋白激酶II α亚基（Casein Kinase II subunit alpha, CK2a1）与5-((4-((2-氨基乙基)(乙基)氨基)-3-(4H-1,2,4-三唑-4-基)苯基)氨基)-7-(环丙基氨基)吡唑并[1,5-a]嘧啶-3-甲腈复合物的晶体结构
描述符：1,2-乙二醇、5-[[4-[2-氨乙基(乙基)氨基]-3-(1,2,4-三唑-4-基)苯基]氨基]-7-(环丙基氨基)吡唑并[1,5-a]嘧啶-3-甲腈、酪蛋白激酶II α亚基……
作者：Kraemer A、Ong H.W、Yang X、Brown J.W、Chang E、Willson T、Knapp S、结构基因组学联盟（Structural Genomics Consortium, SGC）
提交日期：2024-04-12
发布日期：2024-07-31
最后修改日期：2024-08-07
实验方法：X射线衍射（X-RAY DIFFRACTION，分辨率2.18埃）
引用文献：《不仅仅是酰胺生物等排体：发现含1,2,4-三唑的吡唑并[1,5-a]嘧啶类宿主CSNK2抑制剂以对抗β冠状病毒复制》，《药物化学杂志》，第67卷，2024年