Binding Energy Calculation of Patchouli Alcohol Isomer Cyclooxygenase Complexes Suggested as COX-1/COX-2 Selective Inhibitor

Figure 3

Modeling analyses suggest that alpha-Patchouli alcohol isomer binds to COX-1 and COX-2. (a1) to (l1) 3D active site structure of COX-1/COX-2-alpha-Patchouli alcohol isomers (CID 521903, CID6432585, CID442384, CID306022, CID10955174, and CID56928117) complexes; we used Hex 8.0 Docking Software and Discovery Studio 3.5 Viewer Software; (a2) to (l2) Ramachandran plot analysis of COX-1/COX-2-alpha-Patchouli alcohol (CID 521903, CID6432585, CID442384, CID306022, CID10955174, and CID56928117) complexes; we used Discovery Studio 3.5 Viewer Software.