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. Author manuscript; available in PMC: 2013 Dec 27.
Published in final edited form as: J Med Chem. 2012 Dec 7;55(24):10844–10862. doi: 10.1021/jm300519w

Figure 7.

Figure 7

Minimized, top-ranked GOLD pose of compound 14b in ternary complex with DNA and Top1 (constructed in SYBYL). The ligand is colored in cyan, surrounding structures are colored by element, and hydrogens have been omitted. All distances are measured from heavy-atom to heavy-atom. The same water molecules from Figure 4 are shown as red spheres.