KRAS-G12D(1-169) - GDP IN covalent COMPLEX WITH compound (3R,4R)-3

KRAS-G12D(1-169) - GDP IN covalent COMPLEX WITH compound (3R,4R)-3 Descriptor: (2~{R})-2-ethyl-4-[(1~{R},5~{S})-3-[7-(8-ethynyl-7-fluoranyl-3-oxidanyl-naphthalen-1-yl)-8-fluoranyl-2-[[(2~{R},8~{S})-2-fluoranyl-1,2,3,5,6,7-hexahydropyrrolizin-8-yl]methoxy]pyrido[4,3-d]pyrimidin-4-yl]-3,8-diazabicyclo[3.2.1]octan-8-yl]-2-methyl-4-oxidanylidene-butanoic acid, GUANOSINE-5'-DIPHOSPHATE, Isoform 2B of GTPase KRas, ... Authors: Ostermann, N. Deposit date: 2025-03-31 Release date: 2025-07-23 Last modified: 2025-08-06 Method: X-RAY DIFFRACTION (1.546 Å) Cite: Promise and Challenge of beta-Lactone Electrophiles to Target Aspartate 12 of Mutant KRAS G12D . J.Med.Chem., 68, 2025KRAS-G12D(1-169) - 鸟苷-5'-二磷酸（Guanosine-5'-Diphosphate, GDP）与化合物(3R,4R)-3-[(2R)-2-乙基-4-[(1R,5S)-3-[7-(8-乙炔基-7-氟-3-羟基萘-1-基)-8-氟-2-[[(2R,8S)-2-氟-1,2,3,5,6,7-六氢吡咯里嗪-8-基]甲氧基]吡啶并[4,3-d]嘧啶-4-基]-3,8-二氮杂双环[3.2.1]辛烷-8-基]-2-甲基-4-氧代丁酸]形成的共价复合物，样本取自GTP酶KRas的同工型2B。 作者：Ostermann, N. 提交日期：2025-03-31 发布日期：2025-07-23 最后修改日期：2025-08-06 实验方法：X射线衍射（X-RAY DIFFRACTION，衍射波长1.546埃） 引用文献：《靶向突变KRAS G12D天冬氨酸12的β-内酯亲电试剂：机遇与挑战》，《Journal of Medicinal Chemistry》，2025年，第68卷