Predicted ligand sequences
ADAN-name: 1FU52.PDB (view again the scoring matrix)
PDB name: [1FU5.PDB]
Wild-type
ligand sequence and binding properties
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WT | E | E | E | y | M | P | M | E | D | L | y | L | D | I | L |
position |
1 |
2 |
3 |
4 |
5 |
6 |
7 |
8 |
9 |
10 |
11 |
12 |
13 |
14 |
15 |
poly-Ala |
A |
A |
A |
y |
A |
A |
A |
A |
A |
A |
y |
A |
A |
A |
A |
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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|
(Help) |
|
Intraclash |
68.835 |
ΔGbinding |
38.590 |
TOTAL |
107.425 |
|
|
Backbone Hb |
-1.260 |
Cis_bond |
0.000 |
Sidechain Hb |
-4.730 |
Torsional clash |
2.040 |
Van der Waals |
-31.160 |
Backbone clash |
25.030 |
Electrostatics |
0.220 |
Helix dipole |
0.000 |
Solvation Polar |
41.800 |
Water bridges |
-3.680 |
Solvation Hyd |
-38.510 |
Disulfide |
0.000 |
VdW clashes |
36.980 |
Electrost. Kon |
-0.480 |
Entropy sc |
15.280 |
Part.cov.bonds
|
0.000 |
Entropy mc |
22.090 |
ΔGstability |
298.400 |
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Predicted ligand sequences
for template [1FU52.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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