Calculation Parameters
| Chain Sequence(s) |
QVQLQESGPGLVKPSETLSVTCSVSGDSMNNYYWTWIRQSPGKGLEWIGYISDRESATYNPSLNSRVVISRDTSKNQLSLKLNSVTPADTAVYYCATARRGQRIYGVVSFGEFFYYYSMDVWGKGTTVTVSSALSVALGETARISCGRQALGSRAVQWYQHRPGQAPILLIYNNQDRPSGIPERFSGTPDINFGTRATLTISGVEAGDEADYYCHMWDSRSGFSWSFGGATRLTVLG
input.pdb
|
| Selected Chain(s) | F (Heavy), I (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 |
|---|---|---|---|---|
| 1 | Q | F | -2.0827 | Soluble |
| 2 | V | F | 0.0000 | Buried |
| 3 | Q | F | -2.1889 | Soluble |
| 4 | L | F | -1.2913 | Soluble |
| 5 | Q | F | -1.6572 | Soluble |
| 6 | E | F | -1.1263 | Soluble |
| 7 | S | F | -0.8096 | Soluble |
| 8 | G | F | -0.5613 | Soluble |
| 9 | P | F | -0.1255 | Soluble |
| 11 | G | F | 0.4038 | Aggregation-prone |
| 12 | L | F | 1.0336 | Aggregation-prone |
| 13 | V | F | -0.2226 | Soluble |
| 14 | K | F | -1.6548 | Soluble |
| 15 | P | F | -1.2430 | Soluble |
| 16 | S | F | -1.3857 | Soluble |
| 17 | E | F | -1.7690 | Soluble |
| 18 | T | F | -1.4269 | Soluble |
| 19 | L | F | 0.0000 | Buried |
| 20 | S | F | -0.7908 | Soluble |
| 21 | V | F | 0.0000 | Buried |
| 22 | T | F | -0.7328 | Soluble |
| 23 | C | F | 0.0000 | Buried |
| 24 | S | F | -1.2100 | Soluble |
| 25 | V | F | 0.0000 | Buried |
| 26 | S | F | -1.9078 | Soluble |
| 27 | G | F | -2.1578 | Soluble |
| 28 | D | F | -2.9126 | Soluble |
| 29 | S | F | -1.9847 | Soluble |
| 30 | M | F | -1.8508 | Soluble |
| 35 | N | F | -2.2436 | Soluble |
| 36 | N | F | -2.1277 | Soluble |
| 37 | Y | F | -1.4784 | Soluble |
| 38 | Y | F | -1.1914 | Soluble |
| 39 | W | F | 0.0000 | Buried |
| 40 | T | F | 0.0000 | Buried |
| 41 | W | F | 0.0000 | Buried |
| 42 | I | F | 0.0000 | Buried |
| 43 | R | F | -0.5243 | Soluble |
| 44 | Q | F | -0.9162 | Soluble |
| 45 | S | F | -0.9805 | Soluble |
| 46 | P | F | -1.0925 | Soluble |
| 47 | G | F | -1.5047 | Soluble |
| 48 | K | F | -2.2523 | Soluble |
| 49 | G | F | -1.5080 | Soluble |
| 50 | L | F | -0.8968 | Soluble |
| 51 | E | F | -0.9129 | Soluble |
| 52 | W | F | 0.0000 | Buried |
| 53 | I | F | 0.0000 | Buried |
| 54 | G | F | 0.0000 | Buried |
| 55 | Y | F | 0.0264 | Aggregation-prone |
| 56 | I | F | 0.0000 | Buried |
| 57 | S | F | -2.5298 | Soluble |
| 58 | D | F | -3.7083 | Soluble |
| 59 | R | F | -3.6070 | Soluble |
| 63 | E | F | -3.3866 | Soluble |
| 64 | S | F | -1.6964 | Soluble |
| 65 | A | F | -0.4506 | Soluble |
| 66 | T | F | -0.0170 | Soluble |
| 67 | Y | F | 0.0606 | Aggregation-prone |
| 68 | N | F | -0.3604 | Soluble |
| 69 | P | F | -0.6692 | Soluble |
| 70 | S | F | -0.6297 | Soluble |
| 71 | L | F | -0.8488 | Soluble |
| 72 | N | F | -1.6187 | Soluble |
| 74 | S | F | -1.0939 | Soluble |
| 75 | R | F | -1.4201 | Soluble |
| 76 | V | F | 0.0000 | Buried |
| 77 | V | F | 0.3995 | Aggregation-prone |
| 78 | I | F | 0.1446 | Aggregation-prone |
| 79 | S | F | -0.6902 | Soluble |
| 80 | R | F | -1.8386 | Soluble |
| 81 | D | F | -2.2024 | Soluble |
| 82 | T | F | -1.9682 | Soluble |
| 83 | S | F | -1.7755 | Soluble |
| 84 | K | F | -2.7576 | Soluble |
| 85 | N | F | -2.7864 | Soluble |
| 86 | Q | F | -1.9368 | Soluble |
| 87 | L | F | 0.0000 | Buried |
| 88 | S | F | -0.5598 | Soluble |
| 89 | L | F | 0.0000 | Buried |
| 90 | K | F | -0.8928 | Soluble |
| 91 | L | F | -1.1013 | Soluble |
| 92 | N | F | -1.8910 | Soluble |
| 93 | S | F | -1.2914 | Soluble |
| 94 | V | F | 0.0000 | Buried |
| 95 | T | F | -0.7483 | Soluble |
| 96 | P | F | -0.6547 | Soluble |
| 97 | A | F | -0.1881 | Soluble |
| 98 | D | F | -0.3316 | Soluble |
| 99 | T | F | -0.0786 | Soluble |
| 100 | A | F | 0.0000 | Buried |
| 101 | V | F | -0.2342 | 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 | T | F | 0.0000 | Buried |
| 107 | A | F | 0.0000 | Buried |
| 108 | R | F | -2.0317 | Soluble |
| 109 | R | F | -2.1751 | Soluble |
| 110 | G | F | -1.8055 | Soluble |
| 111 | Q | F | -1.5331 | Soluble |
| 111A | R | F | -1.1917 | Soluble |
| 111B | I | F | 0.6987 | Aggregation-prone |
| 111C | Y | F | 1.2223 | Aggregation-prone |
| 111D | G | F | 1.0722 | Aggregation-prone |
| 111E | V | F | 2.1464 | Aggregation-prone |
| 111F | V | F | 2.6803 | Aggregation-prone |
| 112G | S | F | 1.6187 | Aggregation-prone |
| 112F | F | F | 2.2236 | Aggregation-prone |
| 112E | G | F | 1.1010 | Aggregation-prone |
| 112D | E | F | 1.0010 | Aggregation-prone |
| 112C | F | F | 1.0887 | Aggregation-prone |
| 112B | F | F | 0.1294 | Aggregation-prone |
| 112A | Y | F | -0.1010 | Soluble |
| 112 | Y | F | 0.0000 | Buried |
| 113 | Y | F | -0.8880 | Soluble |
| 114 | S | F | -0.8453 | Soluble |
| 115 | M | F | 0.0000 | Buried |
| 116 | D | F | -0.6485 | Soluble |
| 117 | V | F | -0.1628 | Soluble |
| 118 | W | F | -0.2793 | Soluble |
| 119 | G | F | 0.0000 | Buried |
| 120 | K | F | -2.3243 | Soluble |
| 121 | G | F | -1.3308 | Soluble |
| 122 | T | F | -0.7336 | Soluble |
| 123 | T | F | 0.0200 | Aggregation-prone |
| 124 | V | F | 0.0000 | Buried |
| 125 | T | F | 0.1695 | Aggregation-prone |
| 126 | V | F | 0.0000 | Buried |
| 127 | S | F | -0.4447 | Soluble |
| 128 | S | F | -0.6818 | Soluble |
| 129 | A | F | -0.3728 | Soluble |
| 11 | L | I | 0.7660 | Aggregation-prone |
| 12 | S | I | 0.6887 | Aggregation-prone |
| 13 | V | I | 0.0000 | Buried |
| 14 | A | I | 0.5948 | Aggregation-prone |
| 15 | L | I | 0.7648 | Aggregation-prone |
| 16 | G | I | -0.8105 | Soluble |
| 17 | E | I | -1.4196 | Soluble |
| 18 | T | I | -1.2573 | Soluble |
| 19 | A | I | 0.0000 | Buried |
| 20 | R | I | -1.7979 | Soluble |
| 21 | I | I | 0.0000 | Buried |
| 22 | S | I | -1.1203 | Soluble |
| 23 | C | I | -1.2161 | Soluble |
| 24 | G | I | -1.9154 | Soluble |
| 25 | R | I | -2.7528 | Soluble |
| 26 | Q | I | -2.1390 | Soluble |
| 27 | A | I | -1.0427 | Soluble |
| 28 | L | I | -0.1031 | Soluble |
| 29 | G | I | -0.0705 | Soluble |
| 36 | S | I | 0.0069 | Aggregation-prone |
| 37 | R | I | 0.0000 | Buried |
| 38 | A | I | 0.0000 | Buried |
| 39 | V | I | 0.0000 | Buried |
| 40 | Q | I | 0.0000 | Buried |
| 41 | W | I | 0.0000 | Buried |
| 42 | Y | I | 0.0000 | Buried |
| 43 | Q | I | -0.2754 | Soluble |
| 44 | H | I | 0.0000 | Buried |
| 45 | R | I | -1.6007 | Soluble |
| 46 | P | I | -1.3795 | Soluble |
| 47 | G | I | -1.6157 | Soluble |
| 48 | Q | I | -2.0596 | Soluble |
| 49 | A | I | -1.1264 | Soluble |
| 50 | P | I | 0.0000 | Buried |
| 51 | I | I | 0.6228 | Aggregation-prone |
| 52 | L | I | 0.0000 | Buried |
| 53 | L | I | 0.0000 | Buried |
| 54 | I | I | 0.0000 | Buried |
| 55 | Y | I | -0.8227 | Soluble |
| 56 | N | I | -1.4690 | Soluble |
| 57 | N | I | 0.0000 | Buried |
| 65 | Q | I | -2.3110 | Soluble |
| 66 | D | I | -2.1585 | Soluble |
| 67 | R | I | -1.6719 | Soluble |
| 68 | P | I | -0.8148 | Soluble |
| 69 | S | I | -0.6394 | Soluble |
| 70 | G | I | -0.7234 | Soluble |
| 71 | I | I | -0.6795 | Soluble |
| 72 | P | I | -1.3437 | Soluble |
| 74 | E | I | -2.3712 | Soluble |
| 75 | R | I | -1.8311 | Soluble |
| 76 | F | I | 0.0000 | Buried |
| 77 | S | I | -1.2921 | Soluble |
| 78 | G | I | -1.1712 | Soluble |
| 79 | T | I | -0.8012 | Soluble |
| 80 | P | I | -1.0937 | Soluble |
| 81 | D | I | -0.8474 | Soluble |
| 81A | I | I | 1.1135 | Aggregation-prone |
| 82 | N | I | 0.1728 | Aggregation-prone |
| 83 | F | I | 1.3239 | Aggregation-prone |
| 84 | G | I | 0.1785 | Aggregation-prone |
| 85 | T | I | -0.2415 | Soluble |
| 86 | R | I | -1.2969 | Soluble |
| 87 | A | I | 0.0000 | Buried |
| 88 | T | I | -0.8751 | Soluble |
| 89 | L | I | 0.0000 | Buried |
| 90 | T | I | -1.0638 | Soluble |
| 91 | I | I | 0.0000 | Buried |
| 92 | S | I | -1.6385 | Soluble |
| 93 | G | I | -1.0882 | Soluble |
| 94 | V | I | 0.0000 | Buried |
| 95 | E | I | -1.1425 | Soluble |
| 96 | A | I | -0.3815 | Soluble |
| 97 | G | I | -0.8880 | Soluble |
| 98 | D | I | -1.1573 | Soluble |
| 99 | E | I | -1.6498 | Soluble |
| 100 | A | I | 0.0000 | Buried |
| 101 | D | I | 0.0000 | Buried |
| 102 | Y | I | 0.0000 | Buried |
| 103 | Y | I | 0.0000 | Buried |
| 104 | C | I | 0.0000 | Buried |
| 105 | H | I | 0.0000 | Buried |
| 106 | M | I | -0.4261 | Soluble |
| 107 | W | I | 0.0000 | Buried |
| 108 | D | I | -0.5156 | Soluble |
| 109 | S | I | -0.7303 | Soluble |
| 110 | R | I | -1.8605 | Soluble |
| 112 | S | I | -1.0239 | Soluble |
| 113 | G | I | -0.5094 | Soluble |
| 114 | F | I | 0.6711 | Aggregation-prone |
| 115 | S | I | 0.3435 | Aggregation-prone |
| 116 | W | I | 0.1024 | Aggregation-prone |
| 117 | S | I | -0.2906 | Soluble |
| 118 | F | I | 0.0000 | Buried |
| 119 | G | I | -1.0653 | Soluble |
| 120 | G | I | -1.4225 | Soluble |
| 121 | A | I | -1.0793 | Soluble |
| 122 | T | I | -0.8192 | Soluble |
| 123 | R | I | -1.6961 | Soluble |
| 124 | L | I | 0.0000 | Buried |
| 125 | T | I | -0.0010 | Soluble |
| 126 | V | I | 0.6211 | Aggregation-prone |
| 127 | L | I | 1.4963 | Aggregation-prone |
| 128 | G | I | 0.5826 | 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 | -0.5108 | 4.5244 | CSV PDB |
| 4.5 | -0.5534 | 4.4956 | CSV PDB |
| 5.0 | -0.6044 | 4.4517 | CSV PDB |
| 5.5 | -0.6554 | 4.3999 | CSV PDB |
| 6.0 | -0.6981 | 4.3483 | CSV PDB |
| 6.5 | -0.7267 | 4.3052 | CSV PDB |
| 7.0 | -0.7404 | 4.2774 | CSV PDB |
| 7.5 | -0.7438 | 4.2641 | CSV PDB |
| 8.0 | -0.7407 | 4.2591 | CSV PDB |
| 8.5 | -0.7322 | 4.2575 | CSV PDB |
| 9.0 | -0.7181 | 4.2569 | CSV PDB |