TABLE 2.
Steered MD simulations for protein constructs in α-catenin
Constructs (residues) | Domains | Mutation | Type | Velocity/force | Repeats | Trajectory ID |
---|---|---|---|---|---|---|
82–635 | N-M | cv-SMD | 10 Å/ns | 2 | 20–21 | |
82–635 | N-M | cv-SMD | 5 Å/ns | 1 | 22 | |
273–635 | M | cv-SMD | 10 Å/ns | 4 | 23–26 | |
273–635 | M | cv-SMD | 2 Å/ns | 2 | 27–28 | |
273–635 | M | cf-SMD | 100 pN | 2 | 29–30 | |
273–396 | MI | cf-SMD | 100 pN | 2 | 31–32 | |
273–396 | MI | M371W | cf-SMD | 100 pN | 1 | 33 |