MOLECULAR DOCKING STUDIES OF COX INHIBITORS ON WILD-TYPE RAS

Objective: In addition to its role in the formation mechanism of inflammation, binding potential COX inhibitors, which can inhibit tumorogenesis by induce apoptosis, has been explored molecular docking studies on wild-type RAS enzyme. Material and Method: KRAS enzyme (PDB ID: 4OBE), consists is obtained x-ray crystallization method, was chosed considering resolution. The 2D structures ligand molecules were drawn ChemDraw 19.1. MOE 2020 program used form studies. Result Discussion: As a result studies, it understood that presence aromatic 3a 3b critical for ligand-receptor interaction. there must be certain distance between carbonyl group nonpolar part molecule bind receptor site with high affinity. following stages, more effective anticancer drug design an appropriate diameter length, having functional groups containing suitable electron donor or acceptor.