From: Non-nucleosidic inhibition of Herpes simplex virus DNA polymerase: mechanistic insights into the anti-herpetic mode of action of herbal drug withaferin A
Ligand
withaferin A
Docked using
AutoDock
Binding energy
-8.46 Kcal/mol
Ligand efficiency
-0.25
Inhibition constant
624.75 nM
Intermolecular energy
-9.03 Kcal/mol
Total internal energy
-0.8 Kcal/mol