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. Author manuscript; available in PMC: 2014 Sep 15.
Published in final edited form as: Biochem Pharmacol. 2013 Aug 5;86(6):824–835. doi: 10.1016/j.bcp.2013.07.023

Figure 13. Comparison of the binding modes of compound 1 and compound 3 to PXR LBD.

Figure 13

Main interacting side chains identified through docking of compound 1 (green) and compound 3 (cyan) with the PXR LBD. The aryl group of compound 1 can form pi-pi interactions but not the methyl group of compound 3 shown as circle (blue).