Table 2.
In silico prediction of Phl p 6 stabilizing mutations using MAESTRO algorithm.
| Mutant | ΔΔG_pred | c_pred | ASA |
|---|---|---|---|
| N16M | −1.4691 | 0.886 | Buried |
| D52L | −1.3471 | 0.893 | Surface |
| N16F | −1.3469 | 0.970 | Buried |
| N16Y | −1.3052 | 0.982 | Buried |
| E39L | −1.2817 | 0.890 | Surface |
| S46Y | −1.2734 | 0.955 | Buried |
| N16L | −1.2711 | 0.816 | Buried |
| S46F | −1.2654 | 0.930 | Buried |
| M1R | −1.2512 | 0.871 | Surface |
| N16W | −1.2431 | 0.964 | Buried |
Stabilizing mutations selected for expression and further analysis are marked in red. ΔΔG_pred, predicted change in free energy [kcal/mol]. Negative values indicate a stabilizing mutation; c_pred, confidence estimation (0–1) of the prediction; 1, high confidence; ASA, accessible surface area: <30% = buried, >30% = surface exposed.