. Author manuscript; available in PMC: 2008 Aug 28.

Published in final edited form as: J Am Chem Soc. 2005 Jul 20;127(28):9960–9961. doi: 10.1021/ja042485n

Table 2.

The interaction energies (kcal/mol) calculated at the MP2/6-31g(d) level of theory and observed frequency of different CPT sites in the SV40 genome.

Entry	−1^a	+1^a	E_int(MP2)	Frequency (P)%
1	T	G	−6.69	75
2	T	A	−5.97	16
3	T	C	−5.57	7
4	T	T	−4.48	2
5	G	T	−2.76	ND^b
6	G	G	−4.85	ND^b
7	C	G	−5.55	ND^b
8	A	G	−3.03	ND^b

The bases listed correspond to those next to the cleavage site on the cleaved DNA strand.

Not detected.