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. 2023 Mar 24;24(7):6160. doi: 10.3390/ijms24076160

Table 1.

Molecular docking results.

Compound Binding Free Energy Estimate (kcal/mol) Interactions
H-Bond Interactions Hydrophobic Interactions
1,8-Cineole −5.7 - Ser342, Cys285, Ile341, Leu340, Leu333, Met363, Ser289, Arg288, Val339, and Leu330
Amorfrutin B −6.9 Ser342 Ser342, Ile341, Gly284, Leu255, Ile281, Arg288, Met329, Leu330, Ile326, Ala292, Leu333, Met348, Leu353, Val339, Met364, and Cys285