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For molecular docking analysis, the binding site of the enzyme was determined employing the Protein–Ligand Interaction Profiler [44] based on the interaction between the ligand ID: 78H and the enzyme model ID: 3TYA retrieved from the Protein Database (https://www.rcsb.org/) accessed on 19...
However, their docking poses indicated a fruitful interaction pattern, containing similar tacrine interactions (Figure 4). Particularly, the aromatic ring of benzoic acid interacts via a pi–pi stacking with Trp86, like the co-crystallized ligand and Tyr337. Moreover, a water-bridged hydrogen ...