Table 6 Docking result of a best-docked complex of Crizotinib drug with C-MET, C-ROS1 and ALK proteins
Protein name | Type of docking | Docking score | Binding energy (kcal/mol) | Complex energy (kcal/mol) | Interacting residues |
|---|---|---|---|---|---|
DRUG-CRIZOTINIB | |||||
2WGJ | PDB(P6) | 139.105 | − 44.1433 | − 11,179.9569 | PRO1158, MET1160 |
3ZBF | MOTIF(P1) | 114.545 | − 112.0438 | − 11,514.2552 | ASP2033,GLU2027,MET2029 |
2XP2 | RC(S1,P8) | 108.615 | − 189.7012 | − 11,666.7948 | GLU1197, MET1199 |