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. 2013 Oct 22;8(10):e77558. doi: 10.1371/journal.pone.0077558

Figure 8. Docking pose of best binders to the two isozymes placed into the active sites.

Figure 8

Panel A: Docking pose of 1 in the OASS-A binding pocket. Red and green contours identify the hydrogen bond acceptor and hydrophobic GRID MIFs. Hydrogen bond donor hot spots have not been shown for clarity. Panel B: Docking pose of compound 13 in the OASS-B binding pocket. Red and green contours identify the hydrogen bond acceptor and hydrophobic GRID MIFs. Hydrogen bond donor hot spots have not been shown for clarity.