Fig. 13.

3D mapping of SGNA results using a WT PZase conformation as template, showing the conserved (A) lid opening and (B) flap contractions extracted from the PZA-unbinding event from PZase. Hinge residues (H51 and H71) are represented as black spheres, which connect the lid (residue positions 52–70). The arrows show the general direction of movement, inferred for each of the highest degree residues and their corresponding neighbourhood of differential residues. 3D images were generated using MDTraj and NGLView.