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Binding free calculation of NTAT, CTAT and TAT obtained by docking PLP co-factor in Autodock v4.2.
| Modeled Protein | Binding Energy (kcal/mol) | Intermolecular energy (kcal/mol) | Van der Waals energy (kcal/mol) | Electrostatic energy (kcal/mol) | Total internal energy (kcal/mol) | Torsional energy (kcal/mol) |
|---|---|---|---|---|---|---|
| CTAT | – 5.71 | – 7.8 | – 7.12 | – 0.67 | – 0.11 | 2.09 |
| NTAT | – 5.55 | – 7.64 | – 7.0 | – 0.64 | – 0.12 | 2.09 |
| TAT | – 6.26 | – 8.35 | – 7.53 | – 0.82 | – 0.09 | 2.09 |
