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Table 1 Predicted effect on Ebola VP24-KPNA5 complex stability by mutations in Ebola VP24

From: Investigating Ebola virus pathogenicity using molecular dynamics

Mutation mCSM stability
(ΔΔG - kcal/mol)
mCSM PP affinity
(ΔΔG - kcal/mol)
FoldX stability
(ΔΔG - kcal/mol)
R137A −0.80 −1.07 −0.68
Q139A −0.39 −0.24 −0.33
F134A,M136A NA NA −7.3
R137A,T138A,Q139A NA NA −1.02
  1. Prediction from mCSM (stability and affinity) and FoldX (stability) were calculated for the mutated complexes