Compounds | Docking score | Glide energy (kcal/mol) | Interacting amino acid residues |
---|---|---|---|
d2 | − 7.206 | − 51.603 | Phe236, Thr130, Leu129, Tyr126, Tyr140, Ile139, Leu147, His468, Arg469, Cys470 |
d3 | − 8.053 | − 50.625 | Tyr126, Arg385, Cys470, Arg469, His468, Gly465, Gly464, Phe463, Pro462 |
Fluconazole | − 5.847 | − 40.932 | His468, Arg469, Cys470, Ile471, Tyr126, Hie378, Leu380, Leu383, Arg385 |