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. 2021 Oct 27;6(44):29804–29813. doi: 10.1021/acsomega.1c04244

Table 2. Binding Free Energy and the Energetic Contribution for the Interaction between PTP1B and FYGL-3-P.

system PTP1B + FYGL-3-Pa
van der Waals free energy (×102 kJ/mol) –1.2 ± 0.5
electrostatic free energy (×102 kJ/mol) –6.1 ± 2.0
SASA free energy (×102 kJ/mol) –0.18 ± 0.07
polar solvation free energy (×102 kJ/mol) 6.2 ± 2.2
total binding free energy (×102 kJ/mol) –1.2 ± 1.6
a

Data are the mean ± S.E.