Project name: fb818136233ee89

Status: done

Started: 2026-02-08 16:00:31
Settings
Chain sequence(s) L: LAAFRHESEFQAPY
input PDB
Selected Chain(s) L
Distance of aggregation 5 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 L 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                                          (00:00:07)
[INFO]       Main:     Simulation completed successfully.                                          (00:00:08)
Show buried residues

Minimal score value
-1.9681
Maximal score value
1.8229
Average score
-0.0412
Total score value
-0.5771

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
0 L L 1.7906
1 A L 0.4470
2 A L 0.2379
3 F L 1.8229
4 R L -1.4293
5 H L -1.2612
6 E L -1.9681
7 S L -0.8899
8 E L -1.5153
9 F L 1.6028
10 Q L -0.8430
11 A L -0.2266
12 P L 0.2976
13 Y L 1.3575
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Laboratory of Theory of Biopolymers 2018