Predicted ligand sequences
ADAN-name: 1K9R2.PDB (view again the scoring matrix)
PDB name: [1K9R.PDB]
Wild-type
ligand sequence and binding properties
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Grey: Restrictive positions;
only 1 or 2 residues predicted after FoldX analysis
Yellow: Tolerant positions;
more than 10 residues predicted after FoldX analysis
WT ligand |
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Intraclash |
15.194 |
ΔGbinding |
4.160 |
TOTAL |
19.354 |
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Backbone Hb |
-0.637 |
Cis_bond |
0.000 |
Sidechain Hb |
-0.638 |
Torsional clash |
1.898 |
Van der Waals |
-4.845 |
Backbone clash |
0.245 |
Electrostatics |
0.081 |
Helix dipole |
0.000 |
Solvation Polar |
4.378 |
Water bridges |
-0.030 |
Solvation Hyd |
-6.835 |
Disulfide |
0.000 |
VdW clashes |
8.581 |
Electrost. Kon |
-0.008 |
Entropy sc |
0.578 |
Part.cov.bonds
|
0.000 |
Entropy mc |
1.638 |
ΔGstability |
73.002 |
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Predicted ligand sequences
for template [1K9R2.PDB]
(from FoldX scoring matrices).
If your favourite sequence is not included in this
list, please visit the ADAN section
Prediction
from a query sequence).
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