Predicted ligand sequences (modelled structure)
ADAN-name: BZZ1-D1_2A28-21.PDB (view again the scoring matrix)
Starting poly-Ala
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 |
2.080 |
ΔGbinding |
0.700 |
TOTAL |
2.780 |
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Backbone Hb |
-0.638 |
Cis_bond |
0.000 |
Sidechain Hb |
-0.638 |
Torsional clash |
0.142 |
Van der Waals |
-1.579 |
Backbone clash |
0.107 |
Electrostatics |
0.146 |
Helix dipole |
0.000 |
Solvation Polar |
1.955 |
Water bridges |
-0.061 |
Solvation Hyd |
-2.242 |
Disulfide |
0.000 |
VdW clashes |
1.105 |
Electrost. Kon |
0.150 |
Entropy sc |
0.358 |
Part.cov.bonds
|
0.000 |
Entropy mc |
2.001 |
ΔGstability |
85.595 |
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Predicted ligand sequences
for model [BZZ1-D1_2A28-21.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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