FKBP12-FRB in Complex with Compound 11

FKBP12-FRB in Complex with Compound 11 Descriptor: (3S,5R,6R,7E,9R,10R,12R,14S,15E,17E,19E,21S,23S,26R,27R,30R,34aS)-5,9,27-trihydroxy-3-{(2R)-1-[(1S,3R,4R)-4-hydroxy-3-methoxycyclohexyl]propan-2-yl}-10,21-dimethoxy-6,8,12,14,20,26-hexamethyl-5,6,9,10,12,13,14,21,22,23,24,25,26,27,32,33,34,34a-octadecahydro-3H-23,27-epoxypyrido[2,1-c][1,4]oxazacyclohentriacontine-1,11,28,29(4H,31H)-tetrone, 1,2-ETHANEDIOL, Peptidyl-prolyl cis-trans isomerase FKBP1A, ... Authors: Tomlinson, A.C.A, Yano, J.K. Deposit date: 2022-10-11 Release date: 2022-12-28 Last modified: 2023-10-25 Method: X-RAY DIFFRACTION (2.81 Å) Cite: Discovery of RMC-5552, a Selective Bi-Steric Inhibitor of mTORC1, for the Treatment of mTORC1-Activated Tumors. J.Med.Chem., 66, 2023与化合物11结合的FKBP12-FRB复合物描述项：(3S,5R,6R,7E,9R,10R,12R,14S,15E,17E,19E,21S,23S,26R,27R,30R,34aS)-5,9,27-三羟基-3-{(2R)-1-[(1S,3R,4R)-4-羟基-3-甲氧基环己基]丙-2-基}-10,21-二甲氧基-6,8,12,14,20,26-六甲基-5,6,9,10,12,13,14,21,22,23,24,25,26,27,32,33,34,34a-十八氢-3H-23,27-环氧并吡啶并[2,1-c][1,4]氧杂环三十三烷-1,11,28,29(4H,31H)-四酮、1,2-乙二醇、肽基脯氨酰顺反异构酶FKBP1A（Peptidyl-prolyl cis-trans isomerase FKBP1A）等。作者：Tomlinson A.C.A、Yano J.K. 入库日期：2022年10月11日；发布日期：2022年12月28日；最后修改日期：2023年10月25日。检测方法：X射线衍射（X-RAY DIFFRACTION，分辨率2.81埃）。引用：《RMC-5552的发现：一种用于治疗mTORC1激活肿瘤的mTORC1选择性双空间抑制剂》，《J.Med.Chem.》，2023年，第66卷