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Energy component analysis of <i>Sm</i>HMGR complexes with Pitavastatin and analogues.

NIAID Data Ecosystem2026-05-10 收录

数据链接：

https://figshare.com/articles/dataset/Energy_component_analysis_of_i_Sm_i_HMGR_complexes_with_Pitavastatin_and_analogues_/30117395 数据链接链接失效反馈

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资源简介：

Energy component analysis of SmHMGR complexes with Pitavastatin and analogues.

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创建时间：

2025-09-12

蛋白激酶抑制剂

药物靶点相互作用

STRUCTURE OF CAMP-DEPENDENT PROTEIN KINASE, ALPHA-CATALYTIC SUBUNIT IN COMPLEX WITH H7 PROTEIN KINASE INHIBITOR 1-(5-ISOQUINOLINESULFONYL)-2-METHYLPIPERAZINE Descriptor: 1-(5-ISOQUINOLINESULFONYL)-2-M

Protein Data Bank Japan2024-10-23 更新50

A1AR-ADN-Gi-MIPS521

分子动力学模拟

药物靶点相互作用

* Simulations described in the following paper: Positive allosteric mechanisms of adenosine A1 receptor-mediated analgesia, CJ Draper-Joyce, R Bhola, J Wang, A Bhattarai et. al. Nature, 2021, doi: 10.

Figshare2021-09-21 更新50

Summary of the fluorinated drugs’ interaction with different target proteins as median IC50 values and the drugs’ Cmax values. Non-fluorinated or fewer fluorinated drug comparators are denoted by square brackets.

药物靶点相互作用

氟化药物

Figshare2025-09-02 更新10

Structure of NUDT15 R139H Mutant in complex with TH7755

蛋白质晶体结构解析

药物靶点相互作用

Structure of NUDT15 R139H Mutant in complex with TH7755 Descriptor: (R)-6-((2-methyl-4-(1-methyl-1H-indole-5-carbonyl)piperazin-1-yl)sulfonyl)benzo[d]oxazol-2(3H)-one, Nucleotide triphosphate diphosph

Protein Data Bank Japan2024-01-31 更新50

Structure of RORgt in complex with a novel inverse agonist 1

受体结构

药物靶点相互作用

Structure of RORgt in complex with a novel inverse agonist 1 Descriptor: N-[(1R)-1-(4-methoxyphenyl)-2-oxo-2-{[4-(trimethylsilyl)phenyl]amino}ethyl]-N-methyl-3-oxo-2,3-dihydro-1,2-oxazole-5-carboxamid

Protein Data Bank Japan2024-03-13 更新20

Energy component analysis of <i>Sm</i>HMGR complexes with Pitavastatin and analogues.

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