Chain sequence(s) |
A: NKDEAGGNWKQFKGKVKEQWGKLTDDDITIIEGKRDQLVGKIQERYGYQKDQAEKEVVDWETRNEYRWMEGTFTSDVSSYLEGQAAKEFIAWLVRGRG
input PDB |
Selected Chain(s) | A |
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] (00:00:00) [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 A 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 (00:04:33) [INFO] Main: Simulation completed successfully. (00:04:34) |
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 | |
1 | N | A | -3.2324 | |
2 | K | A | -3.9078 | |
3 | D | A | -3.9930 | |
4 | E | A | -3.8646 | |
5 | A | A | 0.0000 | |
6 | G | A | -2.6646 | |
7 | G | A | -2.5570 | |
8 | N | A | -2.2527 | |
9 | W | A | 0.0000 | |
10 | K | A | -2.6009 | |
11 | Q | A | -2.5196 | |
12 | F | A | 0.0000 | |
13 | K | A | 0.0000 | |
14 | G | A | -2.3247 | |
15 | K | A | -2.3832 | |
16 | V | A | 0.0000 | |
17 | K | A | -2.8995 | |
18 | E | A | -3.0443 | |
19 | Q | A | -2.1048 | |
20 | W | A | 0.0000 | |
21 | G | A | -2.1838 | |
22 | K | A | -2.1251 | |
23 | L | A | 0.0000 | |
24 | T | A | -1.0080 | |
25 | D | A | -0.6433 | |
26 | D | A | -0.0221 | |
27 | D | A | 0.0000 | |
28 | I | A | 0.0000 | |
29 | T | A | 0.0000 | |
30 | I | A | 0.0600 | |
31 | I | A | 0.0000 | |
32 | E | A | -2.3334 | |
33 | G | A | -2.2502 | |
34 | K | A | -3.4310 | |
35 | R | A | -3.3699 | |
36 | D | A | -3.5715 | |
37 | Q | A | -2.7205 | |
38 | L | A | 0.0000 | |
39 | V | A | 0.0000 | |
40 | G | A | -2.4273 | |
41 | K | A | -1.9819 | |
42 | I | A | 0.0000 | |
43 | Q | A | -2.8201 | |
44 | E | A | -2.8258 | |
45 | R | A | -2.0018 | |
46 | Y | A | -1.0657 | |
47 | G | A | -1.6172 | |
48 | Y | A | -2.0427 | |
49 | Q | A | -3.2751 | |
50 | K | A | -4.0247 | |
51 | D | A | -4.0356 | |
52 | Q | A | -3.2934 | |
53 | A | A | 0.0000 | |
54 | E | A | -3.5591 | |
55 | K | A | -3.2363 | |
56 | E | A | -2.0720 | |
57 | V | A | 0.0000 | |
58 | V | A | -0.9508 | |
59 | D | A | -1.5207 | |
60 | W | A | 0.0000 | |
61 | E | A | -1.9863 | |
62 | T | A | -2.1722 | |
63 | R | A | -2.9137 | |
64 | N | A | -2.4788 | |
65 | E | A | -2.9930 | |
66 | Y | A | -1.9749 | |
67 | R | A | -2.6280 | |
68 | W | A | -0.5499 | |
69 | M | A | 0.0000 | |
70 | E | A | -2.1222 | |
71 | G | A | -1.3549 | |
72 | T | A | -0.8896 | |
73 | F | A | 0.0000 | |
74 | T | A | -1.6902 | |
75 | S | A | -1.2509 | |
76 | D | A | -2.1309 | |
77 | V | A | 0.0000 | |
78 | S | A | -1.6317 | |
79 | S | A | -1.4737 | |
80 | Y | A | -2.3098 | |
81 | L | A | 0.0000 | |
82 | E | A | -3.1005 | |
83 | G | A | -2.3294 | |
84 | Q | A | -2.5376 | |
85 | A | A | -1.6495 | |
86 | A | A | 0.0000 | |
87 | K | A | -2.7426 | |
88 | E | A | -2.1860 | |
89 | F | A | 0.1059 | |
90 | I | A | 0.0353 | |
91 | A | A | -0.0474 | |
92 | W | A | 0.5511 | |
93 | L | A | 0.3802 | |
94 | V | A | 0.8337 | |
95 | R | A | -1.1461 | |
96 | G | A | -1.2095 | |
97 | R | A | -2.0896 | |
98 | G | A | -1.6695 |