Calculation Parameters
| Chain Sequence(s) |
MQLVQSGPEVKKPGTSVKVSCKASGFTFTSSAVQWVRQARGQRLEWIGWIVVGSGNTNYAQKFQERVTITRDMSTSTAYMELSSLRSEDTAVYYCAAPYCSGGSCFDGFDIWGQGTMVTVSSEIVLTQSPGTLSLSPGERATLSCRASQSVSSSYLAWYQQKPGQAPRLLIYGASSRATGFPDRFSGSGSGTDFTLTISRLEPEDFAVYYCQQYGNSPWTFGQGTKVEI
input.pdb
|
| Selected Chain(s) | H (Heavy), L (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 | H | 0.3141 | Aggregation-prone |
| 3 | Q | H | -0.6409 | Soluble |
| 4 | L | H | 0.0000 | Buried |
| 5 | V | H | 0.5639 | Aggregation-prone |
| 6 | Q | H | -0.1815 | Soluble |
| 7 | S | H | -0.6333 | Soluble |
| 8 | G | H | -0.3080 | Soluble |
| 9 | P | H | -0.3396 | Soluble |
| 11 | E | H | -0.3783 | Soluble |
| 12 | V | H | 0.5347 | Aggregation-prone |
| 13 | K | H | -1.2038 | Soluble |
| 14 | K | H | -2.2639 | Soluble |
| 15 | P | H | -1.9570 | Soluble |
| 16 | G | H | -1.4411 | Soluble |
| 17 | T | H | -1.0832 | Soluble |
| 18 | S | H | -1.2661 | Soluble |
| 19 | V | H | 0.0000 | Buried |
| 20 | K | H | -1.8174 | Soluble |
| 21 | V | H | 0.0000 | Buried |
| 22 | S | H | -0.6111 | Soluble |
| 23 | C | H | 0.0000 | Buried |
| 24 | K | H | -1.4169 | Soluble |
| 25 | A | H | 0.0000 | Buried |
| 26 | S | H | -0.6353 | Soluble |
| 27 | G | H | -0.2922 | Soluble |
| 28 | F | H | 0.0277 | Aggregation-prone |
| 29 | T | H | -0.2365 | Soluble |
| 30 | F | H | 0.0000 | Buried |
| 35 | T | H | -0.2663 | Soluble |
| 36 | S | H | -0.4751 | Soluble |
| 37 | S | H | -0.0213 | Soluble |
| 38 | A | H | 0.1803 | Aggregation-prone |
| 39 | V | H | 0.0000 | Buried |
| 40 | Q | H | 0.0000 | Buried |
| 41 | W | H | 0.0000 | Buried |
| 42 | V | H | 0.0000 | Buried |
| 43 | R | H | -1.0895 | Soluble |
| 44 | Q | H | 0.0000 | Buried |
| 45 | A | H | -2.0129 | Soluble |
| 46 | R | H | -2.7182 | Soluble |
| 47 | G | H | -2.3271 | Soluble |
| 48 | Q | H | -2.9824 | Soluble |
| 49 | R | H | -2.9610 | Soluble |
| 50 | L | H | -1.5803 | Soluble |
| 51 | E | H | -1.7707 | Soluble |
| 52 | W | H | 0.0000 | Buried |
| 53 | I | H | 0.0000 | Buried |
| 54 | G | H | 0.0000 | Buried |
| 55 | W | H | -0.0394 | Soluble |
| 56 | I | H | 0.0000 | Buried |
| 57 | V | H | -0.1766 | Soluble |
| 58 | V | H | 0.0000 | Buried |
| 59 | G | H | -0.5551 | Soluble |
| 62 | S | H | -0.8068 | Soluble |
| 63 | G | H | -1.0565 | Soluble |
| 64 | N | H | -1.4991 | Soluble |
| 65 | T | H | -0.9258 | Soluble |
| 66 | N | H | -1.3435 | Soluble |
| 67 | Y | H | -1.3974 | Soluble |
| 68 | A | H | 0.0000 | Buried |
| 69 | Q | H | -2.5677 | Soluble |
| 70 | K | H | -2.9548 | Soluble |
| 71 | F | H | -2.2994 | Soluble |
| 72 | Q | H | -2.9483 | Soluble |
| 74 | E | H | -3.0123 | Soluble |
| 75 | R | H | -1.9918 | Soluble |
| 76 | V | H | 0.0000 | Buried |
| 77 | T | H | -0.9089 | Soluble |
| 78 | I | H | -0.6583 | Soluble |
| 79 | T | H | -0.6920 | Soluble |
| 80 | R | H | -0.8304 | Soluble |
| 81 | D | H | -0.8524 | Soluble |
| 82 | M | H | -0.1583 | Soluble |
| 83 | S | H | -0.3316 | Soluble |
| 84 | T | H | -0.5490 | Soluble |
| 85 | S | H | -0.7638 | Soluble |
| 86 | T | H | 0.0000 | Buried |
| 87 | A | H | 0.0000 | Buried |
| 88 | Y | H | -0.7402 | Soluble |
| 89 | M | H | -0.8765 | Soluble |
| 90 | E | H | -1.6805 | Soluble |
| 91 | L | H | -1.3515 | Soluble |
| 92 | S | H | -1.2749 | Soluble |
| 93 | S | H | -1.1192 | Soluble |
| 94 | L | H | 0.0000 | Buried |
| 95 | R | H | -2.4136 | Soluble |
| 96 | S | H | -2.1476 | Soluble |
| 97 | E | H | -2.4904 | Soluble |
| 98 | D | H | -1.6592 | Soluble |
| 99 | T | H | -0.9110 | Soluble |
| 100 | A | H | 0.0000 | Buried |
| 101 | V | H | -0.1750 | Soluble |
| 102 | Y | H | -0.1581 | Soluble |
| 103 | Y | H | 0.0000 | Buried |
| 104 | C | H | 0.0000 | Buried |
| 105 | A | H | 0.0000 | Buried |
| 106 | A | H | 0.0000 | Buried |
| 107 | P | H | 0.0000 | Buried |
| 108 | Y | H | 0.5679 | Aggregation-prone |
| 109 | C | H | 0.0000 | Buried |
| 110 | S | H | -0.3583 | Soluble |
| 111 | G | H | -0.7916 | Soluble |
| 111A | G | H | -0.7995 | Soluble |
| 112B | S | H | -0.4819 | Soluble |
| 112A | C | H | -0.0108 | Soluble |
| 112 | F | H | -0.2713 | Soluble |
| 113 | D | H | -1.3032 | Soluble |
| 114 | G | H | 0.0000 | Buried |
| 115 | F | H | 0.0000 | Buried |
| 116 | D | H | -1.0774 | Soluble |
| 117 | I | H | 0.0000 | Buried |
| 118 | W | H | -0.4692 | Soluble |
| 119 | G | H | 0.0000 | Buried |
| 120 | Q | H | -1.1105 | Soluble |
| 121 | G | H | -0.5211 | Soluble |
| 122 | T | H | 0.0000 | Buried |
| 123 | M | H | 0.1386 | Aggregation-prone |
| 124 | V | H | 0.0000 | Buried |
| 125 | T | H | -0.4136 | Soluble |
| 126 | V | H | 0.0000 | Buried |
| 127 | S | H | -0.8251 | Soluble |
| 128 | S | H | -0.6839 | Soluble |
| 1 | E | L | -0.8969 | Soluble |
| 2 | I | L | 1.3641 | Aggregation-prone |
| 3 | V | L | 1.2571 | Aggregation-prone |
| 4 | L | L | 0.0000 | Buried |
| 5 | T | L | 0.0386 | Aggregation-prone |
| 6 | Q | L | 0.0000 | Buried |
| 7 | S | L | -0.7159 | Soluble |
| 8 | P | L | -0.6443 | Soluble |
| 9 | G | L | -0.9690 | Soluble |
| 10 | T | L | -0.8737 | Soluble |
| 11 | L | L | -0.2352 | Soluble |
| 12 | S | L | 0.2533 | Aggregation-prone |
| 13 | L | L | 0.7447 | Aggregation-prone |
| 14 | S | L | -0.1274 | Soluble |
| 15 | P | L | -1.1521 | Soluble |
| 16 | G | L | -1.6995 | Soluble |
| 17 | E | L | 0.0000 | Buried |
| 18 | R | L | -2.4471 | Soluble |
| 19 | A | L | -1.1678 | Soluble |
| 20 | T | L | -0.5661 | Soluble |
| 21 | L | L | 0.0000 | Buried |
| 22 | S | L | -0.8567 | Soluble |
| 23 | C | L | 0.0000 | Buried |
| 24 | R | L | -1.8497 | Soluble |
| 25 | A | L | 0.0000 | Buried |
| 26 | S | L | -0.9279 | Soluble |
| 27 | Q | L | -1.6593 | Soluble |
| 28 | S | L | -1.2272 | Soluble |
| 29 | V | L | -0.5892 | Soluble |
| 30 | S | L | -0.2026 | Soluble |
| 36 | S | L | 0.0392 | Aggregation-prone |
| 37 | S | L | 0.0253 | Aggregation-prone |
| 38 | Y | L | 0.6039 | Aggregation-prone |
| 39 | L | L | 0.0000 | Buried |
| 40 | A | L | 0.0000 | Buried |
| 41 | W | L | 0.0000 | Buried |
| 42 | Y | L | 0.0000 | Buried |
| 43 | Q | L | 0.0000 | Buried |
| 44 | Q | L | -1.0456 | Soluble |
| 45 | K | L | -1.3842 | Soluble |
| 46 | P | L | -1.0729 | Soluble |
| 47 | G | L | -1.6820 | Soluble |
| 48 | Q | L | -2.1626 | Soluble |
| 49 | A | L | 0.0000 | Buried |
| 50 | P | L | 0.0000 | Buried |
| 51 | R | L | -2.1612 | Soluble |
| 52 | L | L | 0.0000 | Buried |
| 53 | L | L | 0.0000 | Buried |
| 54 | I | L | 0.0000 | Buried |
| 55 | Y | L | -0.1515 | Soluble |
| 56 | G | L | 0.0000 | Buried |
| 57 | A | L | 0.0000 | Buried |
| 65 | S | L | -0.3285 | Soluble |
| 66 | S | L | -0.4591 | Soluble |
| 67 | R | L | -0.7151 | Soluble |
| 68 | A | L | -0.4296 | Soluble |
| 69 | T | L | -0.2460 | Soluble |
| 70 | G | L | -0.4588 | Soluble |
| 71 | F | L | -0.3899 | Soluble |
| 72 | P | L | -1.2321 | Soluble |
| 74 | D | L | -2.6902 | Soluble |
| 75 | R | L | -2.7637 | Soluble |
| 76 | F | L | 0.0000 | Buried |
| 77 | S | L | -0.9845 | Soluble |
| 78 | G | L | -0.4019 | Soluble |
| 79 | S | L | -0.5874 | Soluble |
| 80 | G | L | -0.9055 | Soluble |
| 83 | S | L | -0.9514 | Soluble |
| 84 | G | L | -1.1481 | Soluble |
| 85 | T | L | -1.5535 | Soluble |
| 86 | D | L | -1.8870 | Soluble |
| 87 | F | L | 0.0000 | Buried |
| 88 | T | L | -0.8267 | Soluble |
| 89 | L | L | 0.0000 | Buried |
| 90 | T | L | -0.7045 | Soluble |
| 91 | I | L | 0.0000 | Buried |
| 92 | S | L | -2.5048 | Soluble |
| 93 | R | L | -3.2982 | Soluble |
| 94 | L | L | 0.0000 | Buried |
| 95 | E | L | -2.4230 | Soluble |
| 96 | P | L | -1.6274 | Soluble |
| 97 | E | L | -2.2640 | Soluble |
| 98 | D | L | -1.3123 | Soluble |
| 99 | F | L | -0.8492 | Soluble |
| 100 | A | L | -0.8120 | Soluble |
| 101 | V | L | -0.4140 | Soluble |
| 102 | Y | L | 0.0000 | Buried |
| 103 | Y | L | 0.0000 | Buried |
| 104 | C | L | 0.0000 | Buried |
| 105 | Q | L | 0.0000 | Buried |
| 106 | Q | L | -0.2109 | Soluble |
| 107 | Y | L | 0.0000 | Buried |
| 108 | G | L | -0.8462 | Soluble |
| 109 | N | L | -1.6361 | Soluble |
| 114 | S | L | -1.0352 | Soluble |
| 115 | P | L | -1.0840 | Soluble |
| 116 | W | L | -0.7719 | Soluble |
| 117 | T | L | -0.3729 | Soluble |
| 118 | F | L | 0.0000 | Buried |
| 119 | G | L | -0.2726 | Soluble |
| 120 | Q | L | -0.6027 | Soluble |
| 121 | G | L | -0.9086 | Soluble |
| 122 | T | L | 0.0000 | Buried |
| 123 | K | L | -1.8643 | Soluble |
| 124 | V | L | -0.7247 | Soluble |
| 125 | E | L | -0.6012 | Soluble |
| 126 | I | L | 1.4237 | Aggregation-prone |
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 | -0.7104 | 2.5756 | CSV PDB |
| 4.5 | -0.7548 | 2.4516 | CSV PDB |
| 5.0 | -0.8094 | 2.2856 | CSV PDB |
| 5.5 | -0.8636 | 2.1055 | CSV PDB |
| 6.0 | -0.9073 | 1.9389 | CSV PDB |
| 6.5 | -0.9328 | 1.8139 | CSV PDB |
| 7.0 | -0.9379 | 1.7439 | CSV PDB |
| 7.5 | -0.9283 | 1.7144 | CSV PDB |
| 8.0 | -0.9108 | 1.7039 | CSV PDB |
| 8.5 | -0.8881 | 1.7005 | CSV PDB |
| 9.0 | -0.8606 | 1.6994 | CSV PDB |