PatchDock ACE results of MAPK complexes with ATP, GEN and CHY.

NIAID Data Ecosystem2026-03-11 收录

蛋白质-配体对接

激酶药物靶点

数据链接：

https://figshare.com/articles/dataset/PatchDock_ACE_results_of_MAPK_complexes_with_ATP_GEN_and_CHY_/9683831 数据链接链接失效反馈

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资源简介：

PatchDock ACE results of MAPK complexes with ATP, GEN and CHY.

创建时间：

2019-08-19

Ligand binding to FARNESOID-X-RECEPTOR

蛋白质-配体对接

肿瘤药物靶点验证

Ligand binding to FARNESOID-X-RECEPTOR Descriptor: Bile acid receptor, COACTIVATOR PEPTIDE SRC-1 HD3, trans-4-({(2S)-2-cyclohexyl-2-[2-(2,6-dimethoxypyridin-3-yl)-5-fluoro-1H-benzimidazol-1-yl]acetyl}

Protein Data Bank Japan2024-05-22 更新50

NFS1 deficiency enhances the antitumor effects of oxaliplatin via activation of multiple cell death pathways. Homo sapiens

结直肠癌化疗敏感性

激酶药物靶点

Metabolic enzymes play an indispensable role in metabolic reprogramming, and their aberrant expression or activity is associated with the sensitivity to chemotherapy. Hence, targeting metabolic enzyme

NIAID Data Ecosystem30

PPDock: Pocket Prediction-Based Protein–Ligand Blind Docking

蛋白质-配体对接

药物结合口袋预测

Predicting the docking conformation of a ligand in the protein binding site (pocket), i.e., protein–ligand docking, is crucial for drug discovery. Traditional docking methods have a long inference tim

Figshare20

The Human Kinome Targeted by FDA Approved Multi-Target Drugs and Combination Products: A Comparative Study from the Drug-Target Interaction Network Perspective

激酶药物靶点

多靶点药物设计

The human kinome is one of the most productive classes of drug target, and there is emerging necessity for treating complex diseases by means of polypharmacology (multi-target drugs and combination pr

NIAID Data Ecosystem40

Crystal Structure of 1,5-dimethylindoline-2,3-dione covalently bound to the PH domain of Bruton's tyrosine kinase mutant R28C

蛋白质晶体学

激酶药物靶点

Crystal Structure of 1,5-dimethylindoline-2,3-dione covalently bound to the PH domain of Bruton's tyrosine kinase mutant R28C Descriptor: 1,5-dimethyl-3~{H}-indol-2-one, MAGNESIUM ION, Tyrosine-protei

Protein Data Bank Japan2024-11-13 更新30

PatchDock ACE results of MAPK complexes with ATP, GEN and CHY.

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