cluster5_1 protein structure has 32 interfacial amino acids within 5.0 Å cut-off distance. After the interfacial mutation scanning step, 608 possible mutations were built. As the result of box-whisker statistics, 42 outliers were detected within a 1.5xIQR whisker threshold. Among them 11 most enriching and 4 most depleting mutations are proposed as designer mutations.
The most depleting mutation is S60Y with 3.77 ΔΔG score.
The most enriching mutation is D56K with -2.04 ΔΔG score.
The residue that is most frequently leading to a binding depleting is Y170.
The residue that is most frequently leading to a binding enriching is D56.
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Position | Mutation | ΔΔG Binding Score | ΔΔG Stability Score | |
---|---|---|---|---|
G57 | Y | 1.9 | -0.38 | |
S60 | Y | 3.77 | -1.49 | |
Y170 | L | 1.94 | -0.36 | |
P215 | R | 1.84 | -0.49 | |
D56 | K | -2.04 | -0.19 | |
D56 | N | -1.87 | -0.7 | |
D56 | R | -1.54 | -0.7 | |
G57 | R | -1.59 | -1.18 | |
K66 | N | -1.26 | -0.78 | |
K66 | Q | -1.39 | -0.37 | |
K66 | R | -1.48 | -1.4 | |
D103 | T | -1.83 | -0.83 | |
Q147 | R | -1.68 | -0.68 | |
S150 | R | -1.56 | -0.22 | |
K212 | R | -1.37 | -0.43 | |