Skip to main content
. 2019 Jul 19;15(7):e1007225. doi: 10.1371/journal.pcbi.1007225

Table 1. SOD1 Serine to BMAA mutation destabilizes SOD1 dimers.

Folding free energy differences between wild type and mutant SOD1, ΔΔG. Values are mean ± standard deviation among 20 independent runs. Calculations are performed using Eris with both fixed and flexible backbone algorithms for serine to BMAA, and to lysine, for comparison.

Mutation ΔΔG, kcal/mol
BMAA LYS
S25 3.1 ± 0.2 1.9 ± 0.2
S34 3.7 ± 0.4 0.2 ± 0.5
S59 6.9 ± 0.4 0.7 ± 0.4
S68 4.7 ± 0.4 1.9 ± 0.4
S98 3.4 ± 0.2 0.5 ± 0.2
S102 3.9 ± 0.5 -0.1 ± 0.4
S105 6.4 ± 0.5 -0.5 ± 0.6
S107 3.1 ± 0.6 0.8 ± 0.4
S134 4.3 ± 0.6 -0.2 ± 0.6
S142 3.5 ± 0.3 1.4 ± 0.4