Ligands | Binding Score (Kcal/mol) | Protein interaction | Types of interaction | Bond distance Å |
---|---|---|---|---|
Umbelliferone | − 5.6 | TYR400 | Conventional Hydrogen bond Pi-Alkyl | 2.43 |
GLY408 | 3.25 | |||
LYS518 | 5.21 | |||
2,13-octadecadien-1-ol | − 4.7 | PRO410 | Alkyl | 4.25 |
PRO410 | 4.97 | |||
PRO410 | 4.06 | |||
LYS519 | 4.50 | |||
LYS519 | 4.30 | |||
LEU926 | 5.27 | |||
TYR400 | Pi-Alkyl | 4.98 | ||
TYR923 | 5.46 | |||
PHE409 | 4.90 | |||
TYR400 | 4.93 | |||
Ciprofloxacin | − 6.6 | PRO410 | Pi-Sigma | 3.70 |
PHE934 | Pi-Alkyl | 5.28 | ||
PHE409 | 5.12 | |||
PRO410 | 5.06 | |||
LYS518 | Alkyl | 4.14 | ||
PRO410 | 5.15 | |||
ASN403 | Conventional Hydrogen bond | 2.73 |