Table 2.
Compound Name | AutoDock Score (kcal/mol) | Hydrogen Bond Interactions | Hydrophobic Interactions |
---|---|---|---|
4H-Pyran-4-one, 2,3-dihydro-3,5-dihydroxy-6-methyl-(=DDMP) | −5.5 | 384-HIS, 386-LYS, 387-ASN, 480-GLY | 479-ILE |
1,2,3-Benzenetriol (=Pyrogallol) |
−5.6 | 36-ASN, 144-ARG | - |
D-Allose | −6.9 | 56-THR, 110-TYR, 400-ARG |
- |
Dibutyl phthalate | −5.7 | 56-THR | 110-TYR, 143-TYR, 175-ILE, 327-PRO, 396-LEU, 400-ARG, 402-VAL, 483-PRO |
n-Hexadecanoic acid (=Palmitic acid) | −6.3 | 54-GLY, 436-THR | 70-ILE, 110-TYR, 175-ILE, 327-PRO, 396-LEU, 402-VAL, 459-LEU |
9,12-Octadecadienoic acid (Z,Z)- (=Linoleic acid) |
−6.0 | 56-THR | 106-PRO, 110-TYR, 175-ILE, 327-PRO, 396-LEU, 402-VAL, 459-LEU, 483-PRO |
Oleic acid | −5.7 | - | 110-TYR, 327-PRO, 396-LEU, 400-ARG, 402-VAL, 459-LEU, 483-PRO |
Octadecanoic acid (=Stearic acid) |
−5.7 | 110-TYR | 175-ILE, 327-PRO, 396-LEU, 400-ARG, 402-VAL, 459-LEU, 483-PRO |