Table 3.

Comparison of nonadditive perturbation energies, evaluated using GIA and FMC, for different pairwise mutations

Site pairs ΔΔGGIA (±SE) ΔΔGFMC 
 kcal kcal 
A391-E395 −0.15 (±0.56) 9.12 
A391-T469 3.12 (±0.53) 5.49 
A391-V476 −1.33 (±0.55) 6.04 
E395-T469 −0.12 (±0.53) 10.15 (7.5 ± 0.52) 
E395-V476 0.64 (±0.65) 12.68 
T469-V476 1.12 (±0.56) 7.48 
Site pairs ΔΔGGIA (±SE) ΔΔGFMC 
 kcal kcal 
A391-E395 −0.15 (±0.56) 9.12 
A391-T469 3.12 (±0.53) 5.49 
A391-V476 −1.33 (±0.55) 6.04 
E395-T469 −0.12 (±0.53) 10.15 (7.5 ± 0.52) 
E395-V476 0.64 (±0.65) 12.68 
T469-V476 1.12 (±0.56) 7.48 

ΔΔGGIA for each residue pair and its standard error were calculated as described in Materials and methods. ΔΔGFMC was calculated using the Boltzmann slope and V1.2 of the G-V curves for the different mutants, reported in Yifrach and MacKinnon (2002). For the E395-T469 pair, our calculations of ΔΔGFMC using the parameters reported in Table 1 are shown in parentheses.

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