Table 2.
The differences in the protein stabilities between WT and mutant RET and MET kinases
| Kinase | RET active GWT-GMUT | RET active GWT-GMUT | MET inactive GWT-GMUT |
|---|---|---|---|
| ΔEele | −359.99 | 173.16 | −86.42 |
| ΔEvdw | −59.08 | 6.52 | 11.2 |
| ΔEint | 17.53 | 9.03 | 4.49 |
| ΔEgas | −437.54 | 188.70 | −70.74 |
| ΔGgbub | −10.66 | 1.37 | −0.61 |
| ΔGgbele | 405.0 | −164.25 | 41.03 |
| ΔGgbtot | 394.34 | −162.88 | 40.43 |
| ΔEgas+ΔGgbtot | −43.20 | 25.82 | −30.31 |
| ΔTStotal | −28.17 | 16.92 | −12.87 |
| ΔGtotal | −15.03 | 8.90 | −17.44 |
All energies are in Kcal/mol. The contributions of the free energy are defined in Materials and Methods.