Predicted ligand sequences (modelled structure)
ADAN-name: BZZ1-D1_G2B-ABO-16.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 |
3.462 |
ΔGbinding |
3.950 |
TOTAL |
7.412 |
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Backbone Hb |
-0.637 |
Cis_bond |
0.000 |
Sidechain Hb |
-0.637 |
Torsional clash |
0.541 |
Van der Waals |
-4.207 |
Backbone clash |
0.241 |
Electrostatics |
1.018 |
Helix dipole |
0.000 |
Solvation Polar |
4.983 |
Water bridges |
-0.061 |
Solvation Hyd |
-5.894 |
Disulfide |
0.000 |
VdW clashes |
4.236 |
Electrost. Kon |
0.907 |
Entropy sc |
0.603 |
Part.cov.bonds
|
0.000 |
Entropy mc |
3.099 |
ΔGstability |
88.475 |
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Predicted ligand sequences
for model [BZZ1-D1_G2B-ABO-16.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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