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

Protein Data Bank Japan2024-02-07 更新2026-03-28 收录

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The Fk1 domain of FKBP51 in complex with 2-(3-((R)-1-(((S)-1-((S)-2-(5-chlorothiophen-2-yl)-2-(3,4,5-trimethoxyphenyl)acetyl)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-(3,4,5-trimethoxyphenyl)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: 2024-02-07 Method: X-RAY DIFFRACTION (2.1 Å) Cite: Structure-Based Discovery of a New Selectivity-Enabling Motif for the FK506-Binding Protein 51. J.Med.Chem., 66, 2023

本数据集为FK506结合蛋白51（FKBP51）的Fk1结构域与2-(3-((R)-1-(((S)-1-((S)-2-(5-氯噻吩-2-基)-2-(3,4,5-三甲氧基苯基)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，其靶蛋白为肽基脯氨酰顺反异构酶FKBP51。描述符：2-[3-[(1R)-1-[(2S)-1-[(2S)-2-(5-氯噻吩-2-基)-2-(3,4,5-三甲氧基苯基)乙酰基]哌啶-2-基]羰氧基-3-(3,4-二甲氧基苯基)丙基]苯氧基]乙酸作者：Meyners, C、Knaup, F.H、Walz, C.M、Hausch, F. 提交日期：2023-01-27 发布日期：2023-04-26 最后修改日期：2024-02-07 实验方法：X射线衍射（分辨率2.1埃）引用文献：《基于结构发现FK506结合蛋白51的新型选择性基序》，J.Med.Chem.，66卷，2023年

创建时间：

2023-01-27