Predicted ligand sequences (modelled structure)
ADAN-name: BZZ1-D1_1ZUU-1.PDB (view again the scoring matrix)
Starting poly-Ala
ligand sequence and binding properties
(Help)
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 |
|
|
(Help) |
|
Intraclash |
4.502 |
ΔGbinding |
-4.414 |
TOTAL |
0.088 |
|
|
Backbone Hb |
-1.275 |
Cis_bond |
0.000 |
Sidechain Hb |
-1.275 |
Torsional clash |
1.356 |
Van der Waals |
-5.005 |
Backbone clash |
0.209 |
Electrostatics |
-0.308 |
Helix dipole |
0.000 |
Solvation Polar |
5.235 |
Water bridges |
-0.087 |
Solvation Hyd |
-6.933 |
Disulfide |
0.000 |
VdW clashes |
1.630 |
Electrost. Kon |
-0.382 |
Entropy sc |
0.941 |
Part.cov.bonds
|
0.000 |
Entropy mc |
1.690 |
ΔGstability |
13.293 |
|
|
|
|
Predicted ligand sequences
for model [BZZ1-D1_1ZUU-1.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).
|