| Chain sequence(s) |
A: ELMTYGWITGFETME
input PDB |
| Selected Chain(s) | A |
| Distance of aggregation | 10 Å |
| FoldX usage | Yes |
| Dynamic mode | No |
| Automated mutations | No |
| Downloads | Download all the data |
| Simulation log |
[INFO] Logger: Verbosity set to: 2 - [INFO] (00:00:00)
[WARNING] runJob: Working directory already exists (possibly overwriting previous results -ow
to prevent this behavior) (00:00:00)
[INFO] runJob: Starting aggrescan3d job on: input.pdb with A chain(s) selected (00:00:00)
[INFO] runJob: Creating pdb object from: input.pdb (00:00:00)
[INFO] FoldX: Starting FoldX energy minimalization (00:00:00)
[INFO] Analysis: Starting Aggrescan3D on folded.pdb (00:00:07)
[INFO] Main: Simulation completed successfully. (00:00:08)
|
The table below lists A3D score for protein residues. Residues with A3D score > 0.0000 are marked by yellow rows.
| residue index | residue name | chain | Aggrescan3D score | mutation |
|---|---|---|---|---|
| residue index | residue name | chain | Aggrescan3D score | |
| 1 | E | A | -0.4478 | |
| 2 | L | A | 1.9341 | |
| 3 | M | A | 2.1103 | |
| 4 | T | A | 1.7619 | |
| 5 | Y | A | 2.5244 | |
| 6 | G | A | 2.1874 | |
| 7 | W | A | 2.9845 | |
| 8 | I | A | 3.2119 | |
| 9 | T | A | 1.5398 | |
| 10 | G | A | 1.1009 | |
| 11 | F | A | 1.5138 | |
| 12 | E | A | -0.6930 | |
| 13 | T | A | -0.2919 | |
| 14 | M | A | 0.0970 | |
| 15 | E | A | -1.5034 |