Project name: FGKGHGF4

Status: done

Started: 2026-02-20 07:05:57
Settings
Chain sequence(s) A: FGKGHGF
C: FGKGHGF
B: FGKGHGF
D: FGKGHGF
input PDB
Selected Chain(s) A,C,B,D
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                                          (00:00:43)
[INFO]       Main:     Simulation completed successfully.                                          (00:00:44)
Show buried residues

Minimal score value
-3.7414
Maximal score value
3.6039
Average score
-0.2414
Total score value
-6.7588

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 2.2746
2 G A 0.0000
3 K A -3.7414
4 G A -3.1918
5 H A -2.3942
6 G A 0.6027
7 F A 3.4506
1 F B 2.3337
2 G B 0.6330
3 K B -2.6622
4 G B -2.6844
5 H B -2.4516
6 G B -0.5149
7 F B 2.6250
1 F C 1.7263
2 G C -0.7006
3 K C -2.8959
4 G C -1.7362
5 H C -1.1226
6 G C 0.0000
7 F C 3.5779
1 F D 2.2781
2 G D -0.9687
3 K D -2.8753
4 G D 0.0000
5 H D -1.9585
6 G D 0.0337
7 F D 3.6039
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Laboratory of Theory of Biopolymers 2018