Skip to main content
Figure 6 | Journal of Biomedical Science

Figure 6

From: The discovery of potential acetylcholinesterase inhibitors: A combination of pharmacophore modeling, virtual screening, and molecular docking studies

Figure 6

Schematic presentations of the putative huAChE binding modes with compounds (A) NSC659829 and (B) NSC35839. Residues involved in hydrogen-bonding, charge or polar interactions are represented by magenta-colored circles. Residues involved in van der Waals interactions are represented by green circles. The solvent accessible surface of an atom is represented by a blue halo around the atom. The diameter of the circle is proportional to the solvent accessible surface. Hydrogen-bond interactions with amino acid side chains are represented by a blue dashed line with an arrow head directed toward the electron donor. π-π Interactions are represented by an orange line with symbols indicating the interaction.

Back to article page