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. Author manuscript; available in PMC: 2013 Feb 15.
Published in final edited form as: J Am Chem Soc. 2012 Feb 2;134(6):3154–3163. doi: 10.1021/ja210475a

Table 2.

Melting and thermodynamic data for duplexes with single and double substitutions.

DNA
Duplex
Tm @ 3 μM
(°C)
ΔG°37,melt
(kcal/mol)
ΔG°25,melt
(kcal/mol)
ΔG°25,itc
(kcal/mol)
T•A 51.3 −12.80 (± 0.20) −16.02 (± 0.36) −12.22 (± 0.06)a
T•G 43.4 −10.38 (± 0.04) −13.21 (± 0.13) −11.04 (± 0.05)
T•T 38.1 − 8.95 (± 0.02) −11.57 (± 0.09) −10.50 (± 0.04)
T•C 37.4 − 8.80 (± 0.02) −11.52 (± 0.07) −10.18 (± 0.03)
L•A 40.7 − 9.54 (± 0.03) −12.01 (± 0.07) −10.58 (± 0.05)
L•G 36.8 − 8.62 (± 0.03) −10.78 (± 0.14) − 9.86 (± 0.04)
L•T 35.0 − 8.26 (± 0.05) −10.39 (± 0.10) − 9.49 (± 0.03)
L•C 33.5 − 8.00 (± 0.02) −10.10 (± 0.04) − 9.11 (± 0.03)
F•A 38.7 − 9.00 (± 0.07) −11.57 (± 0.16) −10.36 (± 0.03)
F•G 36.0 − 8.46 (± 0.03) −10.93 (± 0.06) − 9.79 (± 0.03)
F•T 34.6 − 8.22 (± 0.07) −10.44 (± 0.12) − 9.59 (± 0.03)
F•C 33.9 − 7.98 (± 0.06) −10.31 (± 0.08) − 9.55 (± 0.02)
23L•A 36.8 − 8.64 (± 0.13) −10.90 (± 0.17) nd
23L•G 37.3 − 8.80 (± 0.09) −11.22 (± 0.18) nd
23L•T 35.8 − 8.46 (± 0.10) −10.55 (± 0.19) nd
23L•C 34.8 − 8.20 (± 0.04) −10.42 (± 0.09) nd
AT•AT 55.0 −14.18 (± 0.16) −17.49 (± 0.26) −13.04 (± 0.11)a
GT•GT 42.4 −10.32 (± 0.15) −13.55 (± 0.34) −10.97 (± 0.05)
TT•TT 34.2 − 7.87 (± 0.03) −11.09 (± 0.06) −10.14 (± 0.01)
CT•CT 31.9 − 7.28 (± 0.04) −10.28 (± 0.04) − 9.39 (± 0.02)
AL•AL 35.6 − 8.34 (± 0.02) −10.96 (± 0.08) − 9.70 (± 0.04)
GL•GL 29.2 − 6.82 (± 0.07) − 9.24 (± 0.03) − 8.49 (± 0.02)
TL•TL 29.7 − 6.82 (± 0.04) − 9.55 (± 0.03) − 8.70 (± 0.02)
CL•CL 23.4 − 5.70 (± 0.14) − 7.99 (± 0.02) − 7.76 (± 0.02)
AF•AF 30.9 − 7.22 (± 0.04) − 9.83 (± 0.05) − 9.38 (± 0.02)
GF•GF 26.8 − 6.35 (± 0.11) − 8.70 (± 0.02) − 8.48 (± 0.01)
TF•TF 27.3 − 6.36 (± 0.10) − 8.91 (± 0.02) − 8.46 (± 0.01)
CF•CF 24.0 − 5.70 (± 0.13) − 8.13 (± 0.01) − 8.04 (± 0.01)
A23L•A23L 29.1 − 7.04 (± 0.19) − 9.24 (± 0.07) nd
G23L•G23L 30.6 − 7.26 (± 0.17) − 9.51 (± 0.09) nd
T23L•T23L 29.3 − 7.01 (± 0.10) − 9.30 (± 0.05) nd
C23L•C23L 26.3 − 6.16 (± 0.13) − 8.65 (± 0.02) nd
a

Indirectly estimated by addition of ΔG° values related to the replacement of an F-A base pair with a T-A base pair; see SI.