Footprinting of Inhibitor Interactions of In Silico Identified Inhibitors of Trypanothione Reductase of Leishmania Parasite
Figure 6
Compound 30 (a) of Cluster 3 in hydrogen bonding interaction with Glu466, Glu467, Thr463, Pro398, and Phe396 of the Z site is in hydrophobic contact with the inhibitor. Compound 35 (b) is in hydrophobic interaction with all the Z site residues, and there are other amino acids in non-boding interactions making it a high-affinity binding.
