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. 2020 Mar 25;25(7):1478. doi: 10.3390/molecules25071478

Figure 6.

Figure 6

Figure 6

Molecular docking studies with the 4DUH receptor. (a) Binding site and docking pose of the co-crystallized ligand interacting with residues. (b) Hydrogen bonds between the residues of the ARG 136, ARG 76, GLT 101 and ASP 73 and the co-crystallized. (c) Docking validation of co-crystallized ligand. (d) Hydrogen bonds between the residues of the GLY 101 and the 5d ligand. (e) Docking validation of 5d. (f) Docking pose of the 5d interacting with residues in the binding site. (g) Hydrogen bonds between the residues of the ASN 46, ILE 78, GLY 77 and the 5e ligand. (h) Docking validation of 5e. (i) Docking pose of the 5e interacting with residues in the binding site.