Table 4.
Sr. No | Compounds | Hydrogen Bonding | Arene–pi Interactions | Binding Energy (S) | |
---|---|---|---|---|---|
01 | K-1 | 2.74, 2.86 1.13, 2.64 2.59 |
Tyr18, Ser39, Tyr24, Arg37, Asn136 |
-- | −0.6467 |
02 | S-2 | 2.48, 1.8, 2.52 |
Lys36, Ser39 | Yes | −4.0720 |
03 | K-2 | 2.47, 2.02 | Lys33, Trp141 |
-- | −3.0564 |
04 | H-4 | 2.32, 1.15 | Gyl151, Ser150 |
yes | −2.5427 |