Table 9.
Chemical interaction analyses of the inhibitory activity of borapetoside A against AG using Discovery Studio.
Receptor (amino acid) | Distance (Å) | Ligand (group) | Receptor (group) | Chemical interaction |
---|---|---|---|---|
ASP327 | 2.30238 | H-Donor | H-Acceptor | Hydrogen bond |
GLN256 | 3.04358 | H-Donor | H-Acceptor | Hydrogen bond |
TYR388 | 5.29125 | Pi-Orbitals | Pi-Orbitals | Hydrophobic |
VAL405 | 5.4311 | Pi-Orbitals | Alkyl | Hydrophobic |