Project name: FGKGHGF12

Status: done

Started: 2026-02-20 07:26:40
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Chain sequence(s) A: FGKGHGF
C: FGKGHGF
B: FGKGHGF
E: FGKGHGF
D: FGKGHGF
G: FGKGHGF
F: FGKGHGF
I: FGKGHGF
H: FGKGHGF
K: FGKGHGF
J: FGKGHGF
L: FGKGHGF
input PDB
Selected Chain(s) A,C,B,E,D,G,F,I,H,K,J,L
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                                          (00:02:16)
[INFO]       Main:     Simulation completed successfully.                                          (00:02:19)
Show buried residues

Minimal score value
-2.0005
Maximal score value
3.4764
Average score
0.0439
Total score value
3.6866

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 2.2555
2 G A -0.0328
3 K A -1.4466
4 G A -1.6142
5 H A -1.4075
6 G A -0.2993
7 F A 1.9186
1 F B 1.3742
2 G B -0.5575
3 K B -1.6587
4 G B -0.7307
5 H B -1.2219
6 G B 0.9618
7 F B 2.2786
1 F C -0.1113
2 G C -0.9661
3 K C -2.0005
4 G C -1.4032
5 H C -0.1830
6 G C -0.1050
7 F C 2.0625
1 F D 1.2342
2 G D -0.5866
3 K D -1.7776
4 G D -0.8742
5 H D -0.4448
6 G D 0.0000
7 F D 1.8340
1 F E 3.1639
2 G E 0.0000
3 K E -0.2791
4 G E -0.7523
5 H E -0.7873
6 G E 0.6118
7 F E 1.9736
1 F F 0.7470
2 G F -0.5511
3 K F -0.8816
4 G F 0.0852
5 H F 1.9010
6 G F 0.0000
7 F F 3.4764
1 F G -0.0064
2 G G 0.0000
3 K G -1.2101
4 G G -0.8356
5 H G -1.0109
6 G G -0.3709
7 F G 1.4460
1 F H 0.6479
2 G H -0.9238
3 K H -1.2665
4 G H 0.0000
5 H H 0.4339
6 G H 1.9747
7 F H 2.2650
1 F I -0.8032
2 G I -0.4895
3 K I -0.7303
4 G I -1.0145
5 H I -0.6570
6 G I 0.6989
7 F I 3.0149
1 F J 1.1520
2 G J -0.4840
3 K J -1.8315
4 G J -1.7115
5 H J -1.2376
6 G J -0.2932
7 F J 1.3936
1 F K 2.2946
2 G K 0.7198
3 K K -0.5734
4 G K -0.6986
5 H K -0.6278
6 G K 0.0000
7 F K 1.8298
1 F L 1.3896
2 G L -0.3659
3 K L -1.4537
4 G L -1.5047
5 H L -1.4589
6 G L -0.5917
7 F L 1.3717
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Laboratory of Theory of Biopolymers 2018