Summary of atomic-resolution simulations of CYP2C9 models.
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https://figshare.com/articles/dataset/_Summary_of_atomic_resolution_simulations_of_CYP2C9_models_/416688
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1. FLO = 4′-hydroxy-flurbiprofen, FLU = Flurbiprofen.
2. The following properties differ among the simulated CYP2C9 models.
a. Solubility (water soluble ‘SOL’ and membrane-bound ‘MEM’ forms).
b. Structure of the FG loop (with F' and G' helices or extended loop).
c. Ligand-bound state (apo ‘APO’, product-bound ‘PROD’ and substrate-bound ‘SUBS’ forms).
创建时间：
2011-08-11
