Project name: FQKGHQF8

Status: done

Started: 2026-05-21 08:38:30
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Chain sequence(s) A: FQKGHQF
C: FQKGHQF
B: FQKGHQF
E: FQKGHQF
D: FQKGHQF
G: FQKGHQF
F: FQKGHQF
H: FQKGHQF
input PDB
Selected Chain(s) A,C,B,E,D,G,F,H
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                                          (00:03:00)
[INFO]       Main:     Simulation completed successfully.                                          (00:03:02)
Show buried residues

Minimal score value
-2.8828
Maximal score value
2.2523
Average score
-0.4912
Total score value
-27.5075

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 1.3372
2 Q A 0.0000
3 K A -1.9555
4 G A 0.0000
5 H A -0.4269
6 Q A -0.2096
7 F A 2.2523
1 F B 1.9442
2 Q B 0.0000
3 K B -1.9282
4 G B 0.0000
5 H B -0.8879
6 Q B -0.4317
7 F B 2.0023
1 F C 1.1923
2 Q C -1.4273
3 K C -2.6616
4 G C -1.3718
5 H C -1.5523
6 Q C -1.2750
7 F C 1.2433
1 F D 1.8821
2 Q D -0.2814
3 K D -2.0016
4 G D 0.0000
5 H D -1.8936
6 Q D -2.1038
7 F D 1.0918
1 F E 1.1789
2 Q E -1.0706
3 K E -1.0862
4 G E -1.1519
5 H E -1.4037
6 Q E -1.1239
7 F E 1.0578
1 F F 1.5528
2 Q F 0.7904
3 K F -0.4518
4 G F -0.9652
5 H F -0.9802
6 Q F -0.8224
7 F F 1.4467
1 F G -0.5691
2 Q G -1.8550
3 K G -2.1890
4 G G -1.5737
5 H G -0.9541
6 Q G -0.6613
7 F G 1.3096
1 F H 0.4923
2 Q H -1.4848
3 K H -2.8828
4 G H -2.3672
5 H H -2.4862
6 Q H -2.0262
7 F H 0.2320
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Laboratory of Theory of Biopolymers 2018