Figure 6 | Scientific Reports

Figure 6

From: Identification of key interactions of benzimidazole resistance-associated amino acid mutations in Ascaris β-tubulins by molecular docking simulations

Figure 6

Superposition comparison of reference crystal structure and Ascaris suum homology model. The reference crystal structure used to create homology models (6FKJ) is shown in red and the representative A. suum isotype A structure which showed the greatest binding affinity from the molecular dynamics simulations is shown in blue. The bound ligands are also shown with TUB075 from the reference structure in green and ABZSO from our A. suum simulations in yellow. The overall RMSD between the structures is 2.52 Å.

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