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. 2022 Apr 12;1262:133019. doi: 10.1016/j.molstruc.2022.133019

Fig. 2.

Fig 2

Amino acid interactions of top lead phytocompounds from the docking analysis and reference inhibitors in substrate binding cavity SARS-CoV-2 2′-O-MTase. (S) solvent-accessible surface view. The top four ranked phytocompounds in sticks representation are represented by colors: (a) cyan: sinefungin (b) orange: SAM (c) gold: mulberrofuran F (d) red: 24-methylene cycloartenol ferulate (e) blue: 10–hydroxyusambarensine (f) Green: 3-benzoylhosloppone. Types of interactions are represented by light purple-dotted line: Green-dotted lines: H-bonds; hydrophobic interactions (Pi-Alkyl, Alkyl and pi-stacking); yellow-dotted lines: purple-dotted line: Pi-Pi T Shaped; Pi-sulfur interactions, pi-stacking interactions, with three-letter abbreviations of amino acids.