The Fk1 domain of FKBP51 in complex with 2-(3-((1R)-1-(((2S)-1-(2-(5-chlorothiophen-2-yl)-2-cyclohexylacetyl)piperidine-2-carbonyl)oxy)-3-(3,4-dimethoxyphenyl)propyl)phenoxy)acetic acid

The Fk1 domain of FKBP51 in complex with 2-(3-((1R)-1-(((2S)-1-(2-(5-chlorothiophen-2-yl)-2-cyclohexylacetyl)piperidine-2-carbonyl)oxy)-3-(3,4-dimethoxyphenyl)propyl)phenoxy)acetic acid Descriptor: 2-[3-[(1~{R})-1-[(2~{S})-1-[(2~{S})-2-(5-chloranylthiophen-2-yl)-2-cyclohexyl-ethanoyl]piperidin-2-yl]carbonyloxy-3-(3,4-dimethoxyphenyl)propyl]phenoxy]ethanoic acid, Peptidyl-prolyl cis-trans isomerase FKBP5 Authors: Meyners, C, Knaup, F.H, Walz, C.M, Hausch, F. Deposit date: 2023-01-27 Release date: 2023-04-26 Last modified: 2024-02-14 Method: X-RAY DIFFRACTION (1.7 Å) Cite: Structure-Based Discovery of a New Selectivity-Enabling Motif for the FK506-Binding Protein 51. J.Med.Chem., 66, 2023

本数据集收录FK506结合蛋白51（FKBP51）的Fk1结构域与2-(3-((1R)-1-(((2S)-1-(2-(5-氯噻吩-2-基)-2-环己基乙酰基)哌啶-2-羰基)氧基)-3-(3,4-二甲氧基苯基)丙基)苯氧基)乙酸形成的复合物。描述符：2-[3-[(1R)-1-[(2S)-1-[(2S)-2-(5-氯噻吩-2-基)-2-环己基乙酰基]哌啶-2-基]羰氧基-3-(3,4-二甲氧基苯基)丙基]苯氧基]乙酸、肽基脯氨酰顺反异构酶FKBP5。作者：Meyners C、Knaup F.H、Walz C.M、Hausch F。沉积日期：2023-01-27；发布日期：2023-04-26；最后修改日期：2024-02-14。实验方法：X射线衍射（分辨率1.7 Å）。引用文献：《基于结构发现FK506结合蛋白51的新型选择性基序》，《药物化学杂志》（J.Med.Chem.），第66卷，2023年。