Table 3. Results of re-docking processes with co-crystallized ligands
Ligand | RMSD (Å) |
1 | 0.4912 |
2 | 0.5184 |
3 | 0.5021 |
- Ligand 1: separated from the complex (native form, not prepared).
- Ligand 2: separated from the complex and re-prepared using mentioned appropriate procedure.
- Ligand 3: built and prepared from the beginning.