Project name: FEFEFEGGGKGH8

Status: done

Started: 2026-02-10 03:20:39
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Chain sequence(s) A: FEFEFEGGGKGH
C: FEFEFEGGGKGH
B: FEFEFEGGGKGH
E: FEFEFEGGGKGH
D: FEFEFEGGGKGH
G: FEFEFEGGGKGH
F: FEFEFEGGGKGH
H: FEFEFEGGGKGH
input PDB
Selected Chain(s) A,C,B,E,D,G,F,H
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]                                                (00:00:01)
[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 all 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                                          (00:05:38)
[INFO]       Main:     Simulation completed successfully.                                          (00:05:40)
Show buried residues

Minimal score value
-5.623
Maximal score value
1.9849
Average score
-2.0213
Total score value
-194.041

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 1.1900
2 E A -1.4842
3 F A 0.0000
4 E A -3.0284
5 F A -2.0777
6 E A -2.9338
7 G A -1.8848
8 G A -2.1821
9 G A -2.5739
10 K A -3.5453
11 G A -3.1028
12 H A -2.2013
1 F B 1.1615
2 E B -1.6947
3 F B -2.3316
4 E B -3.2652
5 F B -3.1540
6 E B -3.2105
7 G B -2.5452
8 G B -2.6977
9 G B -3.4669
10 K B -4.5519
11 G B -3.8851
12 H B -3.2751
1 F C 1.4452
2 E C -0.5787
3 F C -1.6869
4 E C 0.0000
5 F C 0.0000
6 E C 0.0000
7 G C 0.0000
8 G C -2.7523
9 G C 0.0000
10 K C -4.2692
11 G C -3.6396
12 H C -2.8728
1 F D 0.2016
2 E D -3.7699
3 F D 0.0000
4 E D -5.3004
5 F D 0.0000
6 E D -3.7419
7 G D -2.8699
8 G D -2.2282
9 G D -2.9958
10 K D -3.7870
11 G D -3.6361
12 H D -3.2260
1 F E 1.1169
2 E E -3.0221
3 F E 0.0000
4 E E -5.6230
5 F E 0.0000
6 E E -4.5125
7 G E 0.0000
8 G E 0.0000
9 G E -2.5600
10 K E 0.0000
11 G E -3.1776
12 H E -3.1035
1 F F 1.4369
2 E F -2.0222
3 F F 0.0000
4 E F -4.6729
5 F F 0.0000
6 E F -4.4405
7 G F -3.3001
8 G F -2.4030
9 G F -2.0586
10 K F -2.5666
11 G F -2.9176
12 H F -2.8190
1 F G 1.8453
2 E G -0.8236
3 F G 0.0000
4 E G -4.5500
5 F G 0.0000
6 E G -4.1701
7 G G -2.8696
8 G G 0.0000
9 G G -2.5143
10 K G -3.2370
11 G G -3.1938
12 H G -2.7608
1 F H 1.9849
2 E H -1.0320
3 F H -0.8891
4 E H -3.2928
5 F H -2.2361
6 E H -3.0204
7 G H 0.0000
8 G H -2.2800
9 G H -2.7546
10 K H -3.5441
11 G H -3.1549
12 H H -2.4540
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Laboratory of Theory of Biopolymers 2018