Table 3.
Binding free energies analysis of wildtype and mutant ORF6-KPNA2 complexes.
| Complexes | vdW | Electrostatic | GB | SA | Total Binding Energy |
|---|---|---|---|---|---|
| Wild Type | -96.39 | 282.69 | -203.97 | -12.25 | -29.92 |
| V9F | -153.43 | -68.44 | 199.78 | -20.19 | -42.28 |
| V24A | -132.63 | 463.94 | -323.41 | -17.97 | -10.06 |
| W27L | -121.63 | 416.92 | -300.09 | -16.32 | -21.12 |
| I33T | -156.96 | -54.34 | 192.85 | -20.58 | -39.04 |