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. 2020 Oct 24;75(1):9–23. doi: 10.1007/s10858-020-00350-w

Table 3.

R relaxation dispersion fitting parameters for the sample RNA data

AIC RMS kex pb δA0 δB0 R1A R1B R2A R2B
NOEX 906.4 5.48 0.0 ± 0.0 0.0 ± 0.0 0.2 ± 0.08 0.0 ± 0.0 2.4 ± 0.04 0.0 ± 0.0 43.4 ± 4.6 0.0 ± 0.0
TROTT_PALMER 367.1 0.464 114.3 ± 2.3 0.1 ± 0.002 0.0 ± 0.01 4.0 ± 0.04 2.5 ± 0.03 2.5 ± 0.03 28.7 ± 0.4 81.2 ± 11.4
BALDWINKAY 408.3 0.558 105.2 ± 3.5 0.1 ± 0.002 0.0 ± 0.01 3.9 ± 0.04 2.5 ± 0.02 2.5 ± 0.02 34.2 ± 0.4 101.2 ± 17.2
LAGUERRE 571.2 1.178 117.7 ± 5.1 0.11 ± 0.004 − 0.3 ± 0.02 4.0 ± 0.07 2.5 ± 0.01 2.5 ± 0.01 28.5 ± 1.3 28.5 ± 1.3
EXACT0 310.8 0.36 111.6 ± 2.5 0.11 ± 0.002 0.0 ± 0.0 3.9 ± 0.02 2.5 ± 0.03 2.5 ± 0.03 29.0 ± 0.3 130.3 ± 20.0
EIGENEXACT 313.2 0.364 110.7 ± 1.6 0.11 ± 0.002 0.0 ± 0.01 3.9 ± 0.04 2.5 ± 0.03 2.5 ± 0.03 30.3 ± 0.3 67.2 ± 11.5
Literature 116.0 ± 2.0 0.11 ± 0.002 − 3.95 ± 0.02 2.4 ± 0.03 2.4 ± 0.03 28.8 ± 0.2 122.0 ± 15.0

The best fit to the data is shown in bold. Literature values are for the RNA C8 atom at 30 °C from (Zhao et al. 2014)