Crystal structure of KRAS G12D in a transition state mimetic complex with CYPA and RMC-7977

Crystal structure of KRAS G12D in a transition state mimetic complex with CYPA and RMC-7977 Descriptor: (1R,5S,6r)-N-[(1P,7S,9S,13S,20M)-20-{5-(4-cyclopropylpiperazin-1-yl)-2-[(1S)-1-methoxyethyl]pyridin-3-yl}-21-ethyl-17,17-dimethyl-8,14-dioxo-15-oxa-4-thia-9,21,27,28-tetraazapentacyclo[17.5.2.1~2,5~.1~9,13~.0~22,26~]octacosa-1(24),2,5(28),19,22,25-hexaen-7-yl]-3-oxabicyclo[3.1.0]hexane-6-carboxamide, ALUMINUM FLUORIDE, GTPase KRas, ... Authors: Pourfarjam, Y, Goldgur, Y, Cuevas-Navarro, A, Lito, P. Deposit date: 2024-04-18 Release date: 2024-11-06 Last modified: 2026-08-12 Method: X-RAY DIFFRACTION (1.65 Å) Cite: Pharmacological restoration of GTP hydrolysis by mutant RAS. Nature, 637, 2025KRAS G12D与亲环素A（CYPA）及RMC-7977形成的过渡态模拟复合物的晶体结构 描述：(1R,5S,6r)-N-[(1P,7S,9S,13S,20M)-20-{5-(4-环丙基哌嗪-1-基)-2-[(1S)-1-甲氧基乙基]吡啶-3-基}-21-乙基-17,17-二甲基-8,14-二氧代-15-氧杂-4-硫杂-9,21,27,28-四氮杂五环[17.5.2.1~2,5~.1~9,13~.0~22,26~]二十八碳-1(24),2,5(28),19,22,25-六烯-7-基]-3-氧杂双环[3.1.0]己烷-6-甲酰胺、氟化铝、GTP酶KRas…… 作者：Pourfarjam, Y、Goldgur, Y、Cuevas-Navarro, A、Lito, P. 存入日期：2024-04-18 发布日期：2024-11-06 最后修改日期：2025-01-29 实验方法：X射线衍射（1.65埃） 引用：《突变RAS的GTP水解药理学恢复》，《自然》（*Nature*），637卷，2025年