Single-Point Mutation

Results

Predicted Affinity Change (ΔΔGAffinity wt->mt)

0.466 kcal/mol

(Increasing affinity)


Reverse Prediction (ΔΔGAffinity mt->wt)


-1.136 Kcal/mol (Decreasing affinity)

Mutation Details


Chain: I

Position: 45

Wild-type: LEU

Mutant: TRP

Distance from closest partner: 2.72Å

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Interactions

Clash

VDW

Hydrogen Bond

Ionic

Aromatic

Hydrophobic

Carbonyl

Polar

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Interactions: Wild-Type x Mutant
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Wild-Type (dashed lines)

Mutant (straight lines)

Carbonyl

Aromatic

Ionic

VDW

Hydrogen bonds

Hydrophobic

Polar Hbond

Clash

Ring-Ring