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. Author manuscript; available in PMC: 2014 Dec 15.
Published in final edited form as: Bioorg Med Chem Lett. 2013 Oct 8;23(24):10.1016/j.bmcl.2013.09.101. doi: 10.1016/j.bmcl.2013.09.101

Figure 4.

Figure 4

Docked poses of compound 5 (magenta) and compound 7 (orange) overlaid on the crystal structure for compound 5 (white) bound to BpIspF (green) (non-carbon ligand atoms are colored as in Figure 3). Docking poses show favorable binding near a lipophilic pocket created by Ile59, Phe63 and Leu78, supported by crystallographic data. Residues 65 – 67 removed for clarity. Image created using PyMol 14.