Project name: FEFEFEGKGH2

Status: done

Started: 2026-02-10 01:20:59
Settings
Chain sequence(s) A: FEFEFEGKGH
B: FEFEFEGKGH
input PDB
Selected Chain(s) A,B
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]                                                (00:00:01)
[WARNING]    runJob:   Working directory already exists (possibly overwriting previous results -ow 
                       to prevent this behavior)                                                   (00:00:01)
[INFO]       runJob:   Starting aggrescan3d job on: input.pdb with all chain(s) selected           (00:00:01)
[INFO]       runJob:   Creating pdb object from: input.pdb                                         (00:00:01)
[INFO]       FoldX:    Starting FoldX energy minimalization                                        (00:00:01)
[INFO]       Analysis: Starting Aggrescan3D on folded.pdb                                          (00:00:28)
[INFO]       Main:     Simulation completed successfully.                                          (00:00:29)
Show buried residues

Minimal score value
-2.4481
Maximal score value
1.0373
Average score
-1.1108
Total score value
-22.215

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
mutation
1 F A 1.0373
2 E A -0.7956
3 F A -0.5689
4 E A -1.4668
5 F A -0.2919
6 E A -1.6112
7 G A -1.3090
8 K A -1.6437
9 G A -1.2219
10 H A -0.7355
1 F B 0.3227
2 E B -1.3769
3 F B -0.6329
4 E B -1.7780
5 F B -0.6949
6 E B -2.0678
7 G B -1.8790
8 K B -2.4481
9 G B -1.7190
10 H B -1.3339
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Laboratory of Theory of Biopolymers 2018