| Chain sequence(s) |
A: GGGGSGGGGSGGGGS
C: GGGGSGGGGSGGGGS B: GGGGSGGGGSGGGGS E: GGGGSGGGGSGGGGS D: GGGGSGGGGSGGGGS G: GGGGSGGGGSGGGGS F: GGGGSGGGGSGGGGS I: GGGGSGGGGSGGGGS H: GGGGSGGGGSGGGGS K: GGGGSGGGGSGGGGS J: GGGGSGGGGSGGGGS M: GGGGSGGGGSGGGGS L: GGGGSGGGGSGGGGS O: GGGGSGGGGSGGGGS N: GGGGSGGGGSGGGGS Q: GGGGSGGGGSGGGGS P: GGGGSGGGGSGGGGS S: GGGGSGGGGSGGGGS R: GGGGSGGGGSGGGGS T: GGGGSGGGGSGGGGS input PDB |
| Selected Chain(s) | A,C,B,E,D,G,F,I,H,K,J,M,L,O,N,Q,P,S,R,T |
| 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 all 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 (00:00:05)
[INFO] Main: Simulation completed successfully. (00:00:10)
|
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 | G | A | -1.4400 | |
| 2 | G | A | -1.4200 | |
| 3 | G | A | -1.7122 | |
| 4 | G | A | -1.8148 | |
| 5 | S | A | -1.8269 | |
| 6 | G | A | -1.7399 | |
| 7 | G | A | -1.9507 | |
| 8 | G | A | -1.8618 | |
| 9 | G | A | -1.6562 | |
| 10 | S | A | -1.5087 | |
| 11 | G | A | -1.5522 | |
| 12 | G | A | -1.7475 | |
| 13 | G | A | -1.7753 | |
| 14 | G | A | -1.6888 | |
| 15 | S | A | -1.5280 | |
| 1 | G | B | -1.5380 | |
| 2 | G | B | 0.0000 | |
| 3 | G | B | -1.7319 | |
| 4 | G | B | -1.7018 | |
| 5 | S | B | -1.5261 | |
| 6 | G | B | -1.7746 | |
| 7 | G | B | -1.5467 | |
| 8 | G | B | -1.3902 | |
| 9 | G | B | -1.2507 | |
| 10 | S | B | -1.1183 | |
| 11 | G | B | -1.5482 | |
| 12 | G | B | -1.5156 | |
| 13 | G | B | -1.4044 | |
| 14 | G | B | -1.5335 | |
| 15 | S | B | -0.9954 | |
| 1 | G | C | -1.1845 | |
| 2 | G | C | -1.3227 | |
| 3 | G | C | -1.4185 | |
| 4 | G | C | -1.3635 | |
| 5 | S | C | -1.2951 | |
| 6 | G | C | -1.6159 | |
| 7 | G | C | -1.9003 | |
| 8 | G | C | -1.9787 | |
| 9 | G | C | -2.0134 | |
| 10 | S | C | -1.6954 | |
| 11 | G | C | -1.8809 | |
| 12 | G | C | -1.6817 | |
| 13 | G | C | -1.3278 | |
| 14 | G | C | -1.4722 | |
| 15 | S | C | -1.0489 | |
| 1 | G | D | -1.1949 | |
| 2 | G | D | -1.2871 | |
| 3 | G | D | -1.4622 | |
| 4 | G | D | -1.3061 | |
| 5 | S | D | -1.4874 | |
| 6 | G | D | -1.6909 | |
| 7 | G | D | -1.5211 | |
| 8 | G | D | -1.5393 | |
| 9 | G | D | 0.0000 | |
| 10 | S | D | -1.6337 | |
| 11 | G | D | 0.0000 | |
| 12 | G | D | 0.0000 | |
| 13 | G | D | 0.0000 | |
| 14 | G | D | 0.0000 | |
| 15 | S | D | -1.0001 | |
| 1 | G | E | -1.3558 | |
| 2 | G | E | -1.5285 | |
| 3 | G | E | -1.7212 | |
| 4 | G | E | -1.7389 | |
| 5 | S | E | -1.6995 | |
| 6 | G | E | -1.8735 | |
| 7 | G | E | -1.8003 | |
| 8 | G | E | -1.7755 | |
| 9 | G | E | -1.4988 | |
| 10 | S | E | -1.3303 | |
| 11 | G | E | -1.7221 | |
| 12 | G | E | -1.6148 | |
| 13 | G | E | -1.6558 | |
| 14 | G | E | -1.4616 | |
| 15 | S | E | -0.9670 | |
| 1 | G | F | -1.2279 | |
| 2 | G | F | -1.5591 | |
| 3 | G | F | -1.5495 | |
| 4 | G | F | -1.4011 | |
| 5 | S | F | -1.2189 | |
| 6 | G | F | -1.4342 | |
| 7 | G | F | -1.6393 | |
| 8 | G | F | -1.8165 | |
| 9 | G | F | -1.6844 | |
| 10 | S | F | -1.4601 | |
| 11 | G | F | -1.4180 | |
| 12 | G | F | 0.0000 | |
| 13 | G | F | -1.5318 | |
| 14 | G | F | -1.4906 | |
| 15 | S | F | -1.1224 | |
| 1 | G | G | -1.0891 | |
| 2 | G | G | -1.3791 | |
| 3 | G | G | -1.5002 | |
| 4 | G | G | -1.6152 | |
| 5 | S | G | -1.5605 | |
| 6 | G | G | -1.5088 | |
| 7 | G | G | -1.5730 | |
| 8 | G | G | -1.7095 | |
| 9 | G | G | -1.5870 | |
| 10 | S | G | -1.3298 | |
| 11 | G | G | -1.4276 | |
| 12 | G | G | -1.4232 | |
| 13 | G | G | -1.3437 | |
| 14 | G | G | -1.3297 | |
| 15 | S | G | -0.7879 | |
| 1 | G | H | -1.3108 | |
| 2 | G | H | -1.5938 | |
| 3 | G | H | -1.5719 | |
| 4 | G | H | -1.5356 | |
| 5 | S | H | -1.4197 | |
| 6 | G | H | -1.5927 | |
| 7 | G | H | -1.6985 | |
| 8 | G | H | -1.5143 | |
| 9 | G | H | -1.2419 | |
| 10 | S | H | -1.1675 | |
| 11 | G | H | -1.3831 | |
| 12 | G | H | -1.4553 | |
| 13 | G | H | -1.5959 | |
| 14 | G | H | -1.1590 | |
| 15 | S | H | -0.6127 | |
| 1 | G | I | -1.6734 | |
| 2 | G | I | -1.5933 | |
| 3 | G | I | -1.6566 | |
| 4 | G | I | -1.6477 | |
| 5 | S | I | -1.4606 | |
| 6 | G | I | -1.7622 | |
| 7 | G | I | -1.7775 | |
| 8 | G | I | -1.4889 | |
| 9 | G | I | -1.4601 | |
| 10 | S | I | -1.3031 | |
| 11 | G | I | -1.5985 | |
| 12 | G | I | -1.5376 | |
| 13 | G | I | -1.4948 | |
| 14 | G | I | -1.6429 | |
| 15 | S | I | -1.4345 | |
| 1 | G | J | -1.2124 | |
| 2 | G | J | -1.5199 | |
| 3 | G | J | -1.6948 | |
| 4 | G | J | -1.6151 | |
| 5 | S | J | -1.4375 | |
| 6 | G | J | -1.5669 | |
| 7 | G | J | -1.6437 | |
| 8 | G | J | -1.8325 | |
| 9 | G | J | -1.6855 | |
| 10 | S | J | -1.6754 | |
| 11 | G | J | -1.9156 | |
| 12 | G | J | 0.0000 | |
| 13 | G | J | -1.6338 | |
| 14 | G | J | -1.3987 | |
| 15 | S | J | -0.8415 | |
| 1 | G | K | -1.2413 | |
| 2 | G | K | -1.3272 | |
| 3 | G | K | -1.4972 | |
| 4 | G | K | -1.4244 | |
| 5 | S | K | -1.3491 | |
| 6 | G | K | -1.6075 | |
| 7 | G | K | -1.6884 | |
| 8 | G | K | -1.7986 | |
| 9 | G | K | -1.7692 | |
| 10 | S | K | -1.2786 | |
| 11 | G | K | -1.4826 | |
| 12 | G | K | -1.3607 | |
| 13 | G | K | -1.2641 | |
| 14 | G | K | -1.3587 | |
| 15 | S | K | -0.8926 | |
| 1 | G | L | -1.2172 | |
| 2 | G | L | -1.1160 | |
| 3 | G | L | -1.7192 | |
| 4 | G | L | -1.7638 | |
| 5 | S | L | -1.7211 | |
| 6 | G | L | -1.7363 | |
| 7 | G | L | -1.8406 | |
| 8 | G | L | -1.7480 | |
| 9 | G | L | -1.5060 | |
| 10 | S | L | -1.1614 | |
| 11 | G | L | -1.6368 | |
| 12 | G | L | -1.3689 | |
| 13 | G | L | -1.6022 | |
| 14 | G | L | -1.5281 | |
| 15 | S | L | -1.3849 | |
| 1 | G | M | -1.1411 | |
| 2 | G | M | -1.4869 | |
| 3 | G | M | -1.5694 | |
| 4 | G | M | -1.6944 | |
| 5 | S | M | -1.5122 | |
| 6 | G | M | -1.4170 | |
| 7 | G | M | -1.2479 | |
| 8 | G | M | -1.1762 | |
| 9 | G | M | -1.2305 | |
| 10 | S | M | -1.2931 | |
| 11 | G | M | -1.3328 | |
| 12 | G | M | -1.6749 | |
| 13 | G | M | -1.4996 | |
| 14 | G | M | -1.2260 | |
| 15 | S | M | -0.9112 | |
| 1 | G | N | -1.1482 | |
| 2 | G | N | -1.2517 | |
| 3 | G | N | -1.4388 | |
| 4 | G | N | -1.3398 | |
| 5 | S | N | -1.5119 | |
| 6 | G | N | -1.5906 | |
| 7 | G | N | -1.5362 | |
| 8 | G | N | -1.5329 | |
| 9 | G | N | -1.4145 | |
| 10 | S | N | -1.4530 | |
| 11 | G | N | -1.4286 | |
| 12 | G | N | -1.4237 | |
| 13 | G | N | -1.4338 | |
| 14 | G | N | -1.0080 | |
| 15 | S | N | -0.5950 | |
| 1 | G | O | -1.1944 | |
| 2 | G | O | -1.4244 | |
| 3 | G | O | -1.4590 | |
| 4 | G | O | -1.6539 | |
| 5 | S | O | -1.6463 | |
| 6 | G | O | -1.7165 | |
| 7 | G | O | -1.6835 | |
| 8 | G | O | -1.5555 | |
| 9 | G | O | -1.2310 | |
| 10 | S | O | -1.3330 | |
| 11 | G | O | 0.0000 | |
| 12 | G | O | 0.0000 | |
| 13 | G | O | -1.4433 | |
| 14 | G | O | -1.2553 | |
| 15 | S | O | -1.0219 | |
| 1 | G | P | -1.5400 | |
| 2 | G | P | -1.6569 | |
| 3 | G | P | -1.8008 | |
| 4 | G | P | -1.7979 | |
| 5 | S | P | -1.6364 | |
| 6 | G | P | -1.5352 | |
| 7 | G | P | -1.6832 | |
| 8 | G | P | 0.0000 | |
| 9 | G | P | -1.6042 | |
| 10 | S | P | 0.0000 | |
| 11 | G | P | -1.5859 | |
| 12 | G | P | -1.7297 | |
| 13 | G | P | -1.7907 | |
| 14 | G | P | -1.4542 | |
| 15 | S | P | -0.9703 | |
| 1 | G | Q | -1.2181 | |
| 2 | G | Q | -1.4139 | |
| 3 | G | Q | -1.6204 | |
| 4 | G | Q | -1.6691 | |
| 5 | S | Q | -1.5472 | |
| 6 | G | Q | -1.6473 | |
| 7 | G | Q | -1.7160 | |
| 8 | G | Q | -1.7633 | |
| 9 | G | Q | -1.4780 | |
| 10 | S | Q | -1.2506 | |
| 11 | G | Q | -1.4470 | |
| 12 | G | Q | -1.4719 | |
| 13 | G | Q | -1.3753 | |
| 14 | G | Q | -1.3690 | |
| 15 | S | Q | -0.8501 | |
| 1 | G | R | -0.9933 | |
| 2 | G | R | -1.2726 | |
| 3 | G | R | -1.4551 | |
| 4 | G | R | -1.4571 | |
| 5 | S | R | -1.5023 | |
| 6 | G | R | 0.0000 | |
| 7 | G | R | -1.4845 | |
| 8 | G | R | 0.0000 | |
| 9 | G | R | -1.4284 | |
| 10 | S | R | -1.4273 | |
| 11 | G | R | -1.2609 | |
| 12 | G | R | -1.4700 | |
| 13 | G | R | -1.4491 | |
| 14 | G | R | -1.1010 | |
| 15 | S | R | -0.7311 | |
| 1 | G | S | -1.5562 | |
| 2 | G | S | -1.5945 | |
| 3 | G | S | -1.5463 | |
| 4 | G | S | -1.6832 | |
| 5 | S | S | -1.5585 | |
| 6 | G | S | -1.7257 | |
| 7 | G | S | -1.5167 | |
| 8 | G | S | -1.6214 | |
| 9 | G | S | -1.4480 | |
| 10 | S | S | -1.5296 | |
| 11 | G | S | -1.5361 | |
| 12 | G | S | -1.5980 | |
| 13 | G | S | -1.5225 | |
| 14 | G | S | -1.3341 | |
| 15 | S | S | -0.6992 | |
| 1 | G | T | -1.1026 | |
| 2 | G | T | -1.2883 | |
| 3 | G | T | 0.0000 | |
| 4 | G | T | -1.5438 | |
| 5 | S | T | -1.4494 | |
| 6 | G | T | 0.0000 | |
| 7 | G | T | -1.6676 | |
| 8 | G | T | -1.4018 | |
| 9 | G | T | -1.2899 | |
| 10 | S | T | 0.0000 | |
| 11 | G | T | -1.4300 | |
| 12 | G | T | -1.3167 | |
| 13 | G | T | -1.1747 | |
| 14 | G | T | -1.0789 | |
| 15 | S | T | -0.7436 |