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. 2022 Jul 12;1268:133709. doi: 10.1016/j.molstruc.2022.133709

Fig. 6.

Fig. 6:

The interactions between each ligand and amino acid in active pocket. 465 candidates of inhibitors for Mpro of SARS-CoV-2 were screened and could be divided into 11 classes by their scaffolds. Only the ligand with the highest affinity of each scaffold was shown. For each scaffold, the best ligand might be over 1 compound. Two kinds of colors (green and blue) were just used to only guide the eye distinguishing 11 classes of compounds.