Crystal structure of ternary complex of Plasmodium vivax SHMT with glycine and a novel pyrazolopyran 33G: (4S)-6-amino-4-(5-cyano-3'-fluorobiphenyl-3-yl)-4-cyclobutyl-3-methyl-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile

Crystal structure of ternary complex of Plasmodium vivax SHMT with glycine and a novel pyrazolopyran 33G: (4S)-6-amino-4-(5-cyano-3'-fluorobiphenyl-3-yl)-4-cyclobutyl-3-methyl-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile Descriptor: (4S)-6-amino-4-(5-cyano-3'-fluorobiphenyl-3-yl)-4-cyclobutyl-3-methyl-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile, BETA-MERCAPTOETHANOL, CHLORIDE ION, ... Authors: Chitnumsub, P, Jaruwat, A, Leartsakulpanich, U, Witschel, M.C. Deposit date: 2014-06-03 Release date: 2015-03-25 Last modified: 2023-09-27 Method: X-RAY DIFFRACTION (2.2 Å) Cite: Inhibitors of Plasmodial Serine Hydroxymethyltransferase (SHMT): Cocrystal Structures of Pyrazolopyrans with Potent Blood- and Liver-Stage Activities. J.Med.Chem., 58, 2015

间日疟原虫丝氨酸羟甲基转移酶（Serine Hydroxymethyltransferase, SHMT）与甘氨酸及新型吡唑并吡喃类化合物33G：(4S)-6-氨基-4-(5-氰基-3'-氟联苯-3-基)-4-环丁基-3-甲基-2,4-二氢吡喃并[2,3-c]吡唑-5-甲腈形成的三元复合物晶体结构
配体描述：(4S)-6-氨基-4-(5-氰基-3'-氟联苯-3-基)-4-环丁基-3-甲基-2,4-二氢吡喃并[2,3-c]吡唑-5-甲腈、β-巯基乙醇、氯离子……
作者：Chitnumsub, P、Jaruwat, A、Leartsakulpanich, U、Witschel, M.C.
提交日期：2014-06-03
发布日期：2015-03-25
最后修改日期：2023-09-27
测试方法：X射线衍射（分辨率2.2 Å）
引用文献：《疟原虫丝氨酸羟甲基转移酶抑制剂：具有强效红内期与肝内期活性的吡唑并吡喃类共晶结构》，J.Med.Chem.，58卷，2015年