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. 2017 Feb 13;114(9):2241–2246. doi: 10.1073/pnas.1609579114

Table S1.

Thermodynamic properties of sfAFP derived from thermal denaturation at different thermal ramp rates

ΔTt, °C/min Tmid, °C ΔH(Tmid), kcal·mol−1 ΔS(Tmid), cal·mol−1·K−1 ΔH(4 °C),* kcal·mol−1 ΔS(4 °C),* cal·mol−1·K−1 ΔG(4 °C),* kcal·mol−1
0.25 26.8 ± 0.2 56.1 ± 1.9 187 ± 6 46.5 ± 2.0 154 ± 7 3.89 ± 0.15
1 32.5 ± 0.2 57.3 ± 1.9 188 ± 6 45.6 ± 2.0 147 ± 7 4.78 ± 0.20
4 42.2 ± 0.2 54.1 ± 1.9 172 ± 6 38.6 ± 2.1 119 ± 7 5.57 ± 0.29
38.1 ± 3.0 116 ± 12 5.92 ± 0.56

Fitting thermal melts used a fixed ΔCp = 0.408 kcal·mol−1·K−1, which is calculated from ref. 23. See SI Methods for further details.

*

ΔS(4 °C) and ΔG(4 °C) are obtained by fitting the thermal denaturation data referenced to Tref = 4 °C to minimize error propagation. ΔH(4 °C) is then calculated from ΔG(4 °C) + Tref·ΔS(4 °C).

The infinite temperature ramp parameters are calculated by fitting ΔH(4 °C), ΔS(4 °C), and ΔG(4 °C) as a function of the scan rate, ΔTt, assuming an exponential fit, that is,
ΔH(4°C,ΔT/Δt)=ΔH(4°C,ΔT/Δt)+be(ΔT/Δt)/t1.
Additionally, ΔH and ΔS are fit globally with a shared “rate” t1 to facilitate fitting a dataset of only three scan rates.