1jps protein structure has 8 interfacial amino acids within 5.0 Å cut-off distance. After the interfacial mutation scanning step, 152 possible mutations were built. As the result of box-whisker statistics, 15 outliers were detected within a 1.5xIQR whisker threshold. Among them 4 most enriching and 11 most Depleting Mutations are proposed as designer mutations.
The most Depleting Mutation is S94P with 2.25 ΔΔG score.
The most enriching mutation is E93W with -2.0 ΔΔG score.
The residue that is most frequently leading to a binding depleting is Y32.
The residue that is most frequently leading to a binding enriching is E93.
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| Position | Mutation | ΔΔG Protein Stability Score | Mutation Impact on Protein Folding | ΔΔG Binding Affinity Score | Mutation Impact on Protein Binding |
|---|---|---|---|---|---|
| Y32 | A | 1.91 | Negative | 1.66 | Negative |
| Y32 | D | 1.83 | Negative | 1.85 | Negative |
| Y32 | E | 1.45 | Negative | 1.85 | Negative |
| Y32 | G | 2.75 | Negative | 1.74 | Negative |
| Y32 | N | 0.91 | Negative | 1.77 | Negative |
| Y32 | P | 1.54 | Negative | 1.63 | Negative |
| Y32 | Q | 1.59 | Negative | 1.55 | Negative |
| Y32 | R | 0.33 | Negative | 1.7 | Negative |
| Y32 | S | 1.88 | Negative | 1.75 | Negative |
| S94 | P | -0.76 | Positive | 2.25 | Negative |
| S94 | W | -1.73 | Positive | 1.84 | Negative |
| K30 | R | -0.7 | Positive | -1.65 | Positive |
| E93 | M | -0.4 | Positive | -1.4 | Positive |
| E93 | Q | -0.05 | Positive | -1.99 | Positive |
| E93 | W | 1.24 | Negative | -2.0 | Positive |
