Project name: FQFGHGFQF2

Status: done

Started: 2026-05-21 14:56:21
Settings
Chain sequence(s) A: FQFGHGFQF
B: FQFGHGFQF
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]                                                (00:00:00)
[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                                          (00:00:12)
[INFO]       Main:     Simulation completed successfully.                                          (00:00:12)
Show buried residues

Minimal score value
-0.7176
Maximal score value
2.6241
Average score
1.0799
Total score value
19.4374

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 2.4809
2 Q A 0.7021
3 F A 1.3980
4 G A 0.0000
5 H A -0.1904
6 G A 0.3798
7 F A 1.4602
8 Q A 0.9938
9 F A 2.4577
1 F B 2.6241
2 Q B 1.0958
3 F B 1.3349
4 G B -0.2887
5 H B -0.7176
6 G B 0.1958
7 F B 2.0218
8 Q B 0.8662
9 F B 2.6230
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Laboratory of Theory of Biopolymers 2018