Interactions of Desmethoxyyangonin, a Secondary Metabolite from Renealmia alpinia, with Human Monoamine Oxidase-A and Oxidase-B

Table 3

Docking scores and MM/GBSA binding energies of preferred binding poses of desmethoxyyangonin 6 in MAO-A and MAO-B.

Methods	MAO-	MAO-
	−3.89	−7.98
MM/	−35.10	−62.95

monoamine oxidase-A (pdb id: 2Z5X). monoamine oxidase-B (pdb id: 1OJ9). scores obtained by using extra precision module (Kcal/mol). free energy that does not include contributions from receptor or ligand strain (Kcal/mol).