Research Article

Inhibition of Inducible Nitric Oxide Synthase (iNOS) by Andrographolide and In Vitro Evaluation of Its Antiproliferative and Proapoptotic Effects on Cervical Cancer

Table 2

Top 5 conformers of predicted binding energy values of the protein-ligand complex during docking.

ConformersBinding energy (kcal/mol)Inhibition constant (Ki) (μM)Interacting residues

1-8.40697.83ARG199, ASN370, TRP372, GLU377
2-7.842.17ARG199, TRP372, GLU377
3-7.736.84ARG199, TRP372, PRO 350, GLU377
4-7.244.96ARG199, VAL352, TRP372, GLU377
5-6.2326.91ARG199, PHE369, TRP372, GLU377, TYR489