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. Author manuscript; available in PMC: 2022 Oct 10.
Published in final edited form as: J Mol Biol. 2021 Mar 31;433(13):166977. doi: 10.1016/j.jmb.2021.166977

Table 4. Free energy values show that chemical stability is not enhanced for mutant I83 construct at [Ca2+] ≤ 50 μm.

Changes in free energy were determined by comparing the chemical stability of I83 in a calcium-free environment to the stability at a range of calcium concentrations.

I83 WT Ca-site Mutant
ΔGchem, (kcal/mol) Ca-free 3.35 ± 0.20 3.24 ± 0.14
ΔGchem, (kcal/mol) pCa 6 (1 μM) 4.02 ± 0.14 3.36 ± 0.13
ΔGchem, (kcal/mol) pCa 4.3 (50 μM) 4.86 ± 0.05 3.13 ± 0.19
ΔGchem, (kcal/mol) pCa 2 (10 mM) 5.64 ± 0.17 3.85 ± 0.22
p-Value, 0 vs. pCa 6 (1 μM) p < 0.01 p > 0.20
p-Value, pCa 6 vs. pCa 4.3 (50 μM) p < 0.01 p < 0.50
p-Value, pCa 4.3 vs. pCa 2 (10 mM) p < 0.01 p < 0.02