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. Author manuscript; available in PMC: 2017 Feb 6.
Published in final edited form as: Chem Res Toxicol. 2016 May 12;29(6):1029–1040. doi: 10.1021/acs.chemrestox.6b00083

Figure 9.

Figure 9

Correlation of ligand-interaction energy obtained with P450 2A13 4EJG (nicotine-type) and P450 2A13 2P85 (indole-type) (A), P450 2A13 4EJH (NNK-type) and P450 2A6 1Z10 (coumarin-type) (B), P450 2A13 4EJH (NNK-type) and P450 2A6 4EJJ (nicotine-type) (C), P450 2A13 4EJG (nicotine-type) and P450 2A6 4EJJ (nicotine-type) (D), P450 2A6 1Z10 (coumarin-type) and P450 2A6 4EJJ (nicotine-type) (E), and P450 2A6 4EJJ (coumarin-type) and P450 2A6 3T3R (pilocarpine-type).