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. 2020 May 3;18(5):241. doi: 10.3390/md18050241

Figure 5.

Figure 5

The top generated pose of the induced fit docking simulation oriented C18 ceramide (green) in an extended conformation along the space between the helix of the dimerization domain and the β sheets of the SET structure, which was further used as a generated active site for the docking simulations of compounds 1 and 2 within the SET protein.