Project name: c4bcc3004d56f6a

Status: done

Started: 2026-01-21 15:39:52
Settings
Chain sequence(s) L: QVDSVRWMEDLKLMTE
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                                          (00:00:12)
[INFO]       Main:     Simulation completed successfully.                                          (00:00:13)
Show buried residues

Minimal score value
-1.876
Maximal score value
1.4283
Average score
-0.2664
Total score value
-4.2619

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
160 Q L -0.8804
161 V L 1.2230
162 D L -1.4965
163 S L -0.3777
164 V L 0.8429
165 R L -1.6534
166 W L 0.7447
167 M L 0.2216
168 E L -1.8760
169 D L -0.8203
170 L L 0.3457
171 K L -1.3017
172 L L 1.4283
173 M L 1.3875
174 T L -0.2165
175 E L -1.8331
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Laboratory of Theory of Biopolymers 2018