Imatinib docking into the native targets (CSF-1RWT and KITWT) and their mutants (CSF-1RD802V, KITV560G, KITS628N and KITD816V).
收藏Figshare2016-09-28 更新2026-04-29 收录
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https://figshare.com/articles/dataset/Imatinib_docking_into_the_native_targets_CSF-1R_sup_WT_sup_and_KIT_sup_WT_sup_and_their_mutants_CSF-1R_sup_D802V_sup_KIT_sup_V560G_sup_KIT_sup_S628N_sup_and_KIT_sup_D816V_sup_/3878964
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The two energy values, the GLIDE and Induced Fit Docking (IFD) scores, were produced with MAESTRO (Schrödinger release, 2014). The RMSD values were calculated for the predicted docking poses taking crystallographic structure 1T46 as a reference. The IC50 values (μM) are taken from the literature.
创建时间：
2016-09-28
