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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

Table 2.

Spectral binding constants and oxidation results observed for the studied chemicals with P450s 2A13 and 2A6

chemical P450 2A13 P450 2A6
Type I spectra a
Ks (μM)
metabolism b (HPLC) Type I spectra a
Ks (μM)
metabolism b (HPLC)
naphthalene 0.35 ± 0.02 yes 2.9 ± 0.4 yes
2EN 0.080 ± 0.04 yes 1.0 ± 0.1 yes
1NMPE 13.3 ± 3.5 not detected 9.3 ± 1.8 not done
1NEPE 1.1 ± 0.1 yes 11.5 ± 2.3 not done
2NPE 0.42 ± 0.10 yes 33 ± 9 not done
2NMPE 4.9 ± 0.6 not detected 21 ± 0 not done
2NEPE 2.7 ± 0.6 not detected 19 ± 6 not done
phenanthrene 2.3 ± 0.2 yes 2.8 ± 0.4 yes
2EPh 1.1 ± 0.3 yes 3.3 ± 0.4 yes
3EPh 0.45 ± 0.08 yes 3.3 ± 0.9 yes
9EPh 0.95 ± 0.08 not detected ND (10 μM) not done
2PPh 3.9 ± 1.2 yes 1.6 ± 0.2 yes
3PPh 1.2 ± 0.4 yes ND (10 μM) not done
9PPh 6.4 ± 1.0 not detected 13 ± 3 not done
biphenyl 0.88 ± 0.16 yes 2.7 ± 0.5 yes
4EB 1.9 ± 0.2 not detected 5.4 ± 0.5 not detected
4PB 28 ± 12 not detected 7.0 ± 1.9 not done
4BuB 3.4 ± 1.1 not detected 12 ± 2 not done
2BPE 15.4 ± 1.7 yes 15 ± 2 not done
4BPE 0.48 ± 0.06 yes 0.75 ± 0.16 yes
2BMPE 1.7 ± 0.3 not detected 17 ± 3 not done
4BMPE 66 ± 19 not detected 43 ± 33 not done
22BDPE 11 ± 6 not detected 32 ± 9 not done
44BDPE 6.5 ± 1.6 not detected 2.6 ± 0.8 not detected
a

Data reported are means and S.E. Analysis (HPLC) was used for monitoring metabolism. When peak(s) were detected only in the presence of an NADPH-generating system as described in Figure 8, metabolism results were marked as “Yes”. When no metabolite peaks were detected under these assay conditions, results were marked as “not detected”. Several of the chemicals were not examined with P450 2A6 (marked as “not done”).