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. 2021 Jul 21;25:100670. doi: 10.1016/j.imu.2021.100670

Table 3.

Binding energy components from protein-RNA complex.

Energy components WT
MADP1
C241U MADP1 WT hnRNP1 C241U hnRNP1
ΔG Binding −65.5821 −54.6634 −69.2351 −45.8545
ΔG Electrostatic energy −830.265 −188.509 −1253 −1049.28
ΔG Covalent energy 5.812749 2.775439 3.256262 11.40654
ΔG H-bond energy −10.2371 −6.53 −13.99 −10.1914
ΔG Lipophilic energy −4.05164 −4.36723 −2.8212 −4.96648
ΔG pi piinterection energy −9.59606 −3.17418 1.616874 −0.23087
ΔG selfcontactcorrelation −0.06446 −0.00658 −0.02245 −0.17093
ΔG Solv_GB 861.3016 193.0531 1288.897 1101.954
ΔG vdw energy −94.3725 −93.1687 −47.9052 −78.4821