Predicted ligand sequences
ADAN-name: 2A0T2.PDB (view again the scoring matrix)
PDB name: [2A0T.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 |
3.598 |
ΔGbinding |
1.844 |
TOTAL |
5.442 |
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Backbone Hb |
0.000 |
Cis_bond |
0.000 |
Sidechain Hb |
-3.550 |
Torsional clash |
1.593 |
Van der Waals |
-6.192 |
Backbone clash |
0.712 |
Electrostatics |
-0.947 |
Helix dipole |
0.000 |
Solvation Polar |
8.718 |
Water bridges |
-0.142 |
Solvation Hyd |
-7.302 |
Disulfide |
0.000 |
VdW clashes |
4.325 |
Electrost. Kon |
-1.186 |
Entropy sc |
2.034 |
Part.cov.bonds
|
0.000 |
Entropy mc |
4.493 |
ΔGstability |
172.090 |
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Predicted ligand sequences
for template [2A0T2.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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