Compounds
Hydrogen bond(D-H...A)
Distance (Å)
Docking score (Kcal/mol)
Glide energy (Kcal/mol)
5-FU
(Tyr 138)O-H...O
2.73
-4.43
-25.79
(HIS 146)N-H...N
3.08
Table 2:
Glide energy, docking score and hydrogen bond interaction of the ligands with key residues.
