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Fig. 7.

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Fig. 7. Molecular docking analysis of ligand-interaction energies (U values) of 2-ethynylnaphthalene, 2-ethynylphenanthrene, and 4-biphenyl propargyl ether obtained using reported crystal structures of CYP2A13 (4EJH), 2A13 (2P85), 2A13 (3T3S), and 2A13 (4EJG) bound to NNK, indole, pilocarpine, and nicotine, respectively. Data are from Murayama, N., Shimada, T. and Yamazaki, H. (unpublished results).
Toxicological Research 2017;33:79~96
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