Figure 4.
(A) Docking pose of 7 bound to the BoNT/A LC. (B) 2D representation of the predicted binding mode of 7 in the BoNT/A LC active site. Coordination of the hydroxamate and π–π stacking interactions are outlined in red and blue, respectively.
(A) Docking pose of 7 bound to the BoNT/A LC. (B) 2D representation of the predicted binding mode of 7 in the BoNT/A LC active site. Coordination of the hydroxamate and π–π stacking interactions are outlined in red and blue, respectively.