Project name: 33b6669222570d1

Status: done

Started: 2026-05-21 15:54:23
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                                          (00:00:09)
[INFO]       Main:     Simulation completed successfully.                                          (00:00:09)
Show buried residues

Minimal score value
-0.2701
Maximal score value
3.3531
Average score
1.9265
Total score value
34.6768

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 3.3364
2 Q A 2.2118
3 F A 2.2275
4 G A 0.1496
5 H A -0.2550
6 G A 0.9081
7 F A 2.9091
8 Q A 2.8986
9 F A 3.3148
1 F B 3.3531
2 Q B 2.2930
3 F B 2.5073
4 G B 0.2047
5 H B -0.2701
6 G B 0.6434
7 F B 2.3750
8 Q B 2.6771
9 F B 3.1924
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Laboratory of Theory of Biopolymers 2018