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. 2017 Apr 11;112(7):1328–1338. doi: 10.1016/j.bpj.2017.02.031

Table 1.

Best-fit Parameters for NN-na Model of Trp Cooperativity

NN ΔGcoupling
ΔGbind
ΔHcoupling
ΔHbind
ΔCp,coupling
ΔCp,bind
Kd
kcal mol−1 kcal mol−1 kcal mol−1 K−1 μM
0 −7.70 ± 0.21a −13.5 ± 1.4a 0.10 ± 0.10a 4.24 ± 0.12
1 −1.04 ± 0.22a −8.74 ± 0.21 −6.11 ± 1.0a −19.7 ± 1.2 −0.49 ± 0.10a −0.39 ± 0.10 0.80 ± 0.24
2 −1.15 ± 0.22a −8.85 ± 0.21 −4.67 ± 1.4a −18.2 ± 1.4 −0.45 ± 0.11a −0.39 ± 0.10 0.67 ± 0.18

Globally fit parameters are given at a reference temperature of 40°C (313.15 K). Confidence intervals were obtained via bootstrapping with 200 replicates. NN, number of occupied nearest neighbors. Unless otherwise indicated, terms were obtained from the sum of the reference state (e.g., ΔG0) and coupling terms (e.g., ΔGoe and ΔGoo). Equilibrium constants from ΔGbind = RT ln Kd at 40°C.

a

Fitted term.