Project name: 95be1c590440df3

Status: done

Started: 2026-02-08 09:21:36
Settings
Chain sequence(s) L: PGFGPGGGDT
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]                                                (00:00:00)
[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 L 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                                          (00:00:01)
[INFO]       Main:     Simulation completed successfully.                                          (00:00:02)
Show buried residues

Minimal score value
-1.6913
Maximal score value
1.585
Average score
-0.3904
Total score value
-3.9036

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
725 P L -0.3583
726 G L -0.1739
727 F L 1.5850
728 G L -0.1622
729 P L -0.4255
730 G L -0.5986
731 G L -0.6368
732 G L -0.9060
733 D L -1.6913
734 T L -0.5360
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Laboratory of Theory of Biopolymers 2018