Calculation Parameters
| Chain Sequence(s) |
MQLVQSGPEVKKPGTSVKVSCKASGFTFTSSAVQWVRQARGQRLEWIGWIVVGSGNTNYAQKFQERVTITRDMSTSTAYMELSSLRSEDTAVYYCAAPYCSGGSCFDGFDIWGQGTMVTVSSEIVLTQSPGTLSLSPGERATLSCRASQSVSSSYLAWYQQKPGQAPRLLIYGASSRATGFPDRFSGSGSGTDFTLTISRLEPEDFAVYYCQQYGNSPWTFGQGTKVEIR
input.pdb
|
| Selected Chain(s) | F (Heavy), G (Light) |
| Distance of Aggregation | 10 Å |
| FoldX Energy Minimization | Yes |
| pH Calculations | Yes |
| Downloads | Download all data (.tar.gz) |
Aggrescan4D Profile
Per-Residue A4D Scores
Download CSVResidues with A4D score > 0.0 are highlighted as aggregation-prone.
| Index | Residue | Chain | A4D Score | Classification |
|---|---|---|---|---|
| 2 | M | F | 0.4253 | Aggregation-prone |
| 3 | Q | F | -0.9262 | Soluble |
| 4 | L | F | 0.0000 | Buried |
| 5 | V | F | -0.3850 | Soluble |
| 6 | Q | F | 0.0000 | Buried |
| 7 | S | F | -0.7244 | Soluble |
| 8 | G | F | -0.5171 | Soluble |
| 9 | P | F | -0.2647 | Soluble |
| 11 | E | F | -0.6645 | Soluble |
| 12 | V | F | 0.2041 | Aggregation-prone |
| 13 | K | F | -1.9235 | Soluble |
| 14 | K | F | -2.6071 | Soluble |
| 15 | P | F | -2.3207 | Soluble |
| 16 | G | F | -1.8991 | Soluble |
| 17 | T | F | -1.3551 | Soluble |
| 18 | S | F | -1.2690 | Soluble |
| 19 | V | F | -1.2508 | Soluble |
| 20 | K | F | -1.7707 | Soluble |
| 21 | V | F | 0.0000 | Buried |
| 22 | S | F | -0.6215 | Soluble |
| 23 | C | F | 0.0000 | Buried |
| 24 | K | F | -1.4837 | Soluble |
| 25 | A | F | 0.0000 | Buried |
| 26 | S | F | -0.5483 | Soluble |
| 27 | G | F | -0.1434 | Soluble |
| 28 | F | F | 0.1226 | Aggregation-prone |
| 29 | T | F | -0.1080 | Soluble |
| 30 | F | F | 0.1435 | Aggregation-prone |
| 35 | T | F | -0.1060 | Soluble |
| 36 | S | F | -0.3826 | Soluble |
| 37 | S | F | 0.0000 | Buried |
| 38 | A | F | 0.1064 | Aggregation-prone |
| 39 | V | F | 0.0000 | Buried |
| 40 | Q | F | 0.0000 | Buried |
| 41 | W | F | 0.0000 | Buried |
| 42 | V | F | 0.0000 | Buried |
| 43 | R | F | -0.8466 | Soluble |
| 44 | Q | F | 0.0000 | Buried |
| 45 | A | F | -1.7454 | Soluble |
| 46 | R | F | -2.5525 | Soluble |
| 47 | G | F | -2.0043 | Soluble |
| 48 | Q | F | -2.3847 | Soluble |
| 49 | R | F | -1.7346 | Soluble |
| 50 | L | F | 0.0000 | Buried |
| 51 | E | F | -1.6859 | Soluble |
| 52 | W | F | 0.0000 | Buried |
| 53 | I | F | 0.0000 | Buried |
| 54 | G | F | 0.0000 | Buried |
| 55 | W | F | -0.1223 | Soluble |
| 56 | I | F | 0.0000 | Buried |
| 57 | V | F | -0.0834 | Soluble |
| 58 | V | F | 0.0000 | Buried |
| 59 | G | F | -0.7493 | Soluble |
| 62 | S | F | -1.0878 | Soluble |
| 63 | G | F | -1.4499 | Soluble |
| 64 | N | F | -1.8892 | Soluble |
| 65 | T | F | -1.3728 | Soluble |
| 66 | N | F | -1.7809 | Soluble |
| 67 | Y | F | -1.6543 | Soluble |
| 68 | A | F | 0.0000 | Buried |
| 69 | Q | F | -2.5793 | Soluble |
| 70 | K | F | -2.8536 | Soluble |
| 71 | F | F | -2.3955 | Soluble |
| 72 | Q | F | -3.0500 | Soluble |
| 74 | E | F | -3.0360 | Soluble |
| 75 | R | F | -1.9664 | Soluble |
| 76 | V | F | 0.0000 | Buried |
| 77 | T | F | -0.9561 | Soluble |
| 78 | I | F | 0.0000 | Buried |
| 79 | T | F | -0.6823 | Soluble |
| 80 | R | F | -1.4308 | Soluble |
| 81 | D | F | -0.7785 | Soluble |
| 82 | M | F | 0.2400 | Aggregation-prone |
| 83 | S | F | -0.0966 | Soluble |
| 84 | T | F | -0.2992 | Soluble |
| 85 | S | F | -0.4943 | Soluble |
| 86 | T | F | 0.0000 | Buried |
| 87 | A | F | 0.0000 | Buried |
| 88 | Y | F | -0.6163 | Soluble |
| 89 | M | F | 0.0000 | Buried |
| 90 | E | F | -0.9279 | Soluble |
| 91 | L | F | 0.0000 | Buried |
| 92 | S | F | -1.1337 | Soluble |
| 93 | S | F | -1.3168 | Soluble |
| 94 | L | F | 0.0000 | Buried |
| 95 | R | F | -2.9977 | Soluble |
| 96 | S | F | -2.4071 | Soluble |
| 97 | E | F | -2.6339 | Soluble |
| 98 | D | F | -1.6783 | Soluble |
| 99 | T | F | -1.0611 | Soluble |
| 100 | A | F | 0.0000 | Buried |
| 101 | V | F | -0.1701 | Soluble |
| 102 | Y | F | 0.0000 | Buried |
| 103 | Y | F | 0.0000 | Buried |
| 104 | C | F | 0.0000 | Buried |
| 105 | A | F | 0.0000 | Buried |
| 106 | A | F | 0.0000 | Buried |
| 107 | P | F | 0.0000 | Buried |
| 108 | Y | F | 0.8427 | Aggregation-prone |
| 109 | C | F | 0.0000 | Buried |
| 110 | S | F | -0.3013 | Soluble |
| 111 | G | F | -0.7523 | Soluble |
| 111A | G | F | -0.6778 | Soluble |
| 112B | S | F | -0.3273 | Soluble |
| 112A | C | F | 0.2861 | Aggregation-prone |
| 112 | F | F | 0.3446 | Aggregation-prone |
| 113 | D | F | -0.2388 | Soluble |
| 114 | G | F | 0.0000 | Buried |
| 115 | F | F | 0.0000 | Buried |
| 116 | D | F | -0.1632 | Soluble |
| 117 | I | F | 0.1663 | Aggregation-prone |
| 118 | W | F | -0.1965 | Soluble |
| 119 | G | F | -0.6537 | Soluble |
| 120 | Q | F | -0.9387 | Soluble |
| 121 | G | F | -0.4985 | Soluble |
| 122 | T | F | 0.0000 | Buried |
| 123 | M | F | 0.3284 | Aggregation-prone |
| 124 | V | F | 0.1232 | Aggregation-prone |
| 125 | T | F | -0.3336 | Soluble |
| 126 | V | F | -1.1409 | Soluble |
| 127 | S | F | -0.5812 | Soluble |
| 128 | S | F | -0.7435 | Soluble |
| 1 | E | G | -0.8615 | Soluble |
| 2 | I | G | 0.7024 | Aggregation-prone |
| 3 | V | G | 1.0451 | Aggregation-prone |
| 4 | L | G | 0.0000 | Buried |
| 5 | T | G | 0.0541 | Aggregation-prone |
| 6 | Q | G | -0.4829 | Soluble |
| 7 | S | G | -0.5491 | Soluble |
| 8 | P | G | -0.5951 | Soluble |
| 9 | G | G | -0.8659 | Soluble |
| 10 | T | G | -0.6270 | Soluble |
| 11 | L | G | 0.0722 | Aggregation-prone |
| 12 | S | G | 0.0160 | Aggregation-prone |
| 13 | L | G | -0.0708 | Soluble |
| 14 | S | G | -0.7614 | Soluble |
| 15 | P | G | -1.3983 | Soluble |
| 16 | G | G | -1.8319 | Soluble |
| 17 | E | G | 0.0000 | Buried |
| 18 | R | G | -2.1889 | Soluble |
| 19 | A | G | -0.8038 | Soluble |
| 20 | T | G | -0.4641 | Soluble |
| 21 | L | G | 0.0000 | Buried |
| 22 | S | G | 0.0000 | Buried |
| 23 | C | G | 0.0000 | Buried |
| 24 | R | G | -0.8070 | Soluble |
| 25 | A | G | 0.0000 | Buried |
| 26 | S | G | -0.8353 | Soluble |
| 27 | Q | G | -1.6101 | Soluble |
| 28 | S | G | -1.3595 | Soluble |
| 29 | V | G | -0.6306 | Soluble |
| 30 | S | G | -0.3169 | Soluble |
| 36 | S | G | -0.1710 | Soluble |
| 37 | S | G | 0.1141 | Aggregation-prone |
| 38 | Y | G | 0.6265 | Aggregation-prone |
| 39 | L | G | 0.0000 | Buried |
| 40 | A | G | 0.0000 | Buried |
| 41 | W | G | 0.0000 | Buried |
| 42 | Y | G | 0.0000 | Buried |
| 43 | Q | G | -0.5995 | Soluble |
| 44 | Q | G | 0.0000 | Buried |
| 45 | K | G | -1.9262 | Soluble |
| 46 | P | G | -1.7601 | Soluble |
| 47 | G | G | -1.8028 | Soluble |
| 48 | Q | G | -2.0597 | Soluble |
| 49 | A | G | 0.0000 | Buried |
| 50 | P | G | 0.0000 | Buried |
| 51 | R | G | -0.7962 | Soluble |
| 52 | L | G | 0.0000 | Buried |
| 53 | L | G | 0.0000 | Buried |
| 54 | I | G | 0.0000 | Buried |
| 55 | Y | G | -0.2416 | Soluble |
| 56 | G | G | 0.0000 | Buried |
| 57 | A | G | -0.4312 | Soluble |
| 65 | S | G | -0.5369 | Soluble |
| 66 | S | G | -1.0817 | Soluble |
| 67 | R | G | -2.2458 | Soluble |
| 68 | A | G | -1.1040 | Soluble |
| 69 | T | G | -0.5202 | Soluble |
| 70 | G | G | -0.7538 | Soluble |
| 71 | F | G | -0.4418 | Soluble |
| 72 | P | G | -1.3826 | Soluble |
| 74 | D | G | -2.6673 | Soluble |
| 75 | R | G | -2.9262 | Soluble |
| 76 | F | G | -1.6299 | Soluble |
| 77 | S | G | -1.1708 | Soluble |
| 78 | G | G | -0.5021 | Soluble |
| 79 | S | G | -0.5571 | Soluble |
| 80 | G | G | -0.7973 | Soluble |
| 83 | S | G | -0.8969 | Soluble |
| 84 | G | G | -1.1510 | Soluble |
| 85 | T | G | -1.0289 | Soluble |
| 86 | D | G | -1.1477 | Soluble |
| 87 | F | G | 0.0000 | Buried |
| 88 | T | G | -0.4942 | Soluble |
| 89 | L | G | 0.0000 | Buried |
| 90 | T | G | -0.5549 | Soluble |
| 91 | I | G | -0.9642 | Soluble |
| 92 | S | G | -1.9313 | Soluble |
| 93 | R | G | -2.9265 | Soluble |
| 94 | L | G | -2.3545 | Soluble |
| 95 | E | G | -2.9752 | Soluble |
| 96 | P | G | -2.0635 | Soluble |
| 97 | E | G | -2.4866 | Soluble |
| 98 | D | G | -1.7723 | Soluble |
| 99 | F | G | -0.9224 | Soluble |
| 100 | A | G | -1.0714 | Soluble |
| 101 | V | G | 0.0000 | Buried |
| 102 | Y | G | -0.5181 | Soluble |
| 103 | Y | G | 0.0000 | Buried |
| 104 | C | G | 0.0000 | Buried |
| 105 | Q | G | 0.0000 | Buried |
| 106 | Q | G | 0.0000 | Buried |
| 107 | Y | G | 0.0000 | Buried |
| 108 | G | G | -0.6195 | Soluble |
| 109 | N | G | -0.7367 | Soluble |
| 114 | S | G | -0.8650 | Soluble |
| 115 | P | G | -0.7976 | Soluble |
| 116 | W | G | -0.2976 | Soluble |
| 117 | T | G | 0.0000 | Buried |
| 118 | F | G | 0.0000 | Buried |
| 119 | G | G | 0.0000 | Buried |
| 120 | Q | G | -0.5712 | Soluble |
| 121 | G | G | -0.9813 | Soluble |
| 122 | T | G | 0.0000 | Buried |
| 123 | K | G | -1.6991 | Soluble |
| 124 | V | G | -0.3306 | Soluble |
| 125 | E | G | -0.2365 | Soluble |
| 126 | I | G | 0.8698 | Aggregation-prone |
| 127 | R | G | -0.9733 | Soluble |
3D Structure — colored by A4D score
pH-Dependent Aggregation Profiles
A4D scores calculated across 11 pH conditions (4.0–9.0, step 0.5). Click a row to view the structure at that pH. The input structure is globular — max score is recommended for pH analysis.
| pH | Avg A4D Score | Max A4D Score | Downloads |
|---|---|---|---|
| 4.0 | -0.791 | 2.0899 | CSV PDB |
| 4.5 | -0.8286 | 2.0246 | CSV PDB |
| 5.0 | -0.8738 | 1.9264 | CSV PDB |
| 5.5 | -0.9173 | 1.8112 | CSV PDB |
| 6.0 | -0.9493 | 1.6973 | CSV PDB |
| 6.5 | -0.9622 | 1.603 | CSV PDB |
| 7.0 | -0.9549 | 1.5428 | CSV PDB |
| 7.5 | -0.9334 | 1.5145 | CSV PDB |
| 8.0 | -0.904 | 1.5039 | CSV PDB |
| 8.5 | -0.8699 | 1.5003 | CSV PDB |
| 9.0 | -0.8324 | 1.4992 | CSV PDB |