遇见数据集

LSD1-CoREST in complex with T16, long soaking

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Protein Data Bank Japan2025-08-20 更新2026-05-23 收录
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LSD1-CoREST in complex with T16, long soaking Descriptor: Lysine-specific histone demethylase 1A, REST corepressor 1, [(2R,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-3,4-dihydroxyoxolan-2-yl]methyl (2R,3S,4S)-2,3,4-trihydroxy-5-[(1R,3S,3aS,13R)-1-hydroxy-10,11-dimethyl-3-[3-(methylcarbamoyl)phenyl]-4,6-dioxo-2,3,5,6-tetrahydro-1H-benzo[g]pyrrolo[2,1-e]pteridin-8(4H)-yl]pentyl dihydrogen diphosphate (non-preferred name) Authors: Caroli, J, Mattevi, A. Deposit date: 2023-10-16 Release date: 2025-02-05 Last modified: 2025-08-20 Method: X-RAY DIFFRACTION (2.74 Å) Cite: Covalent adduct Grob fragmentation underlies LSD1 demethylase-specific inhibitor mechanism of action and resistance. Nat Commun, 16, 2025

与T16结合的LSD1-CoREST复合物(长时浸泡实验) 描述信息:赖氨酸特异性组蛋白去甲基化酶1A(Lysine-specific histone demethylase 1A)、REST共阻遏蛋白1(REST corepressor 1)、[(2R,3S,4R,5R)-5-(6-氨基-9H-嘌呤-9-基)-3,4-二羟基氧杂环戊烷-2-基]甲基 (2R,3S,4S)-2,3,4-三羟基-5-[(1R,3S,3aS,13R)-1-羟基-10,11-二甲基-3-[3-(甲基甲酰胺基)苯基]-4,6-二氧代-2,3,5,6-四氢-1H-苯并[g]吡咯并[2,1-e]蝶啶-8(4H)-基]戊基二氢二磷酸酯(非优选名称) 作者:Caroli, J、Mattevi, A. 提交日期:2023-10-16 发布日期:2025-02-05 最后修改日期:2025-08-20 实验方法:X射线衍射(X-RAY DIFFRACTION),分辨率2.74埃 引用文献:《共价加合物的Grob碎裂揭示LSD1去甲基化酶特异性抑制剂的作用机制与耐药性》,《自然·通讯》(Nat Commun),2025年,第16卷

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2023-10-16
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