Project name: FGGHKGG4

Status: done

Started: 2026-05-21 14:05:51
Settings
Chain sequence(s) A: FGGHKGG
C: FGGHKGG
B: FGGHKGG
D: FGGHKGG
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]                                                (00:00:00)
[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 all 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                                          (00:01:46)
[INFO]       Main:     Simulation completed successfully.                                          (00:01:47)
Show buried residues

Minimal score value
-3.5062
Maximal score value
3.6952
Average score
-1.0339
Total score value
-28.9499

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 3.6652
2 G A 0.7997
3 G A -0.6066
4 H A -1.9700
5 K A -1.8400
6 G A -1.4912
7 G A -1.0388
1 F B 3.6952
2 G B 1.1340
3 G B -0.3255
4 H B -1.2628
5 K B -2.2430
6 G B -1.0672
7 G B -1.2289
1 F C -0.1424
2 G C -0.3377
3 G C -1.4826
4 H C -2.8268
5 K C -3.5062
6 G C -2.2812
7 G C -1.6705
1 F D -0.2773
2 G D -1.1254
3 G D -1.8127
4 H D -2.7687
5 K D -3.3681
6 G D -2.3526
7 G D -1.2178
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Laboratory of Theory of Biopolymers 2018