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 | -1.8074 | Soluble |
| 2 | V | F | -1.4101 | Soluble |
| 3 | Q | F | -1.6069 | Soluble |
| 4 | L | F | -1.2327 | Soluble |
| 5 | Q | F | -1.9628 | Soluble |
| 6 | E | F | -1.5238 | Soluble |
| 7 | S | F | -1.1243 | Soluble |
| 8 | G | F | -0.5888 | Soluble |
| 9 | P | F | -0.1253 | Soluble |
| 11 | G | F | 0.1828 | Aggregation-prone |
| 12 | L | F | 1.0097 | Aggregation-prone |
| 13 | V | F | -0.4208 | Soluble |
| 14 | K | F | -1.8505 | Soluble |
| 15 | P | F | -1.5810 | Soluble |
| 16 | S | F | -1.9116 | Soluble |
| 17 | E | F | -2.9173 | Soluble |
| 18 | T | F | -2.0409 | Soluble |
| 19 | L | F | 0.0000 | Buried |
| 20 | S | F | -1.0484 | Soluble |
| 21 | V | F | 0.0000 | Buried |
| 22 | T | F | -0.8082 | Soluble |
| 23 | C | F | 0.0000 | Buried |
| 24 | S | F | -1.2660 | Soluble |
| 25 | V | F | 0.0000 | Buried |
| 26 | S | F | -1.5846 | Soluble |
| 27 | G | F | -1.9309 | Soluble |
| 28 | D | F | -2.6904 | Soluble |
| 29 | S | F | -1.7751 | Soluble |
| 30 | M | F | -1.7166 | Soluble |
| 35 | N | F | -2.2779 | Soluble |
| 36 | N | F | -2.4015 | Soluble |
| 37 | Y | F | -1.6720 | Soluble |
| 38 | Y | F | -1.0610 | 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 | 0.0000 | Buried |
| 44 | Q | F | -0.9249 | Soluble |
| 45 | S | F | -1.0695 | Soluble |
| 46 | P | F | -1.1271 | Soluble |
| 47 | G | F | -1.4841 | Soluble |
| 48 | K | F | -2.2649 | Soluble |
| 49 | G | F | -1.5105 | Soluble |
| 50 | L | F | 0.0000 | Buried |
| 51 | E | F | -1.0687 | Soluble |
| 52 | W | F | 0.0000 | Buried |
| 53 | I | F | 0.0000 | Buried |
| 54 | G | F | 0.0000 | Buried |
| 55 | Y | F | 0.0111 | Aggregation-prone |
| 56 | I | F | 0.0000 | Buried |
| 57 | S | F | -2.2981 | Soluble |
| 58 | D | F | -3.0106 | Soluble |
| 59 | R | F | -3.2509 | Soluble |
| 63 | E | F | -3.1788 | Soluble |
| 64 | S | F | -1.7777 | Soluble |
| 65 | A | F | -0.5474 | Soluble |
| 66 | T | F | -0.0369 | Soluble |
| 67 | Y | F | 0.1207 | Aggregation-prone |
| 68 | N | F | 0.0000 | Buried |
| 69 | P | F | -0.6715 | Soluble |
| 70 | S | F | -0.6787 | Soluble |
| 71 | L | F | -0.8579 | Soluble |
| 72 | N | F | -1.6151 | Soluble |
| 74 | S | F | -1.1269 | Soluble |
| 75 | R | F | -1.5554 | Soluble |
| 76 | V | F | 0.0000 | Buried |
| 77 | V | F | 0.0194 | Aggregation-prone |
| 78 | I | F | 0.0000 | Buried |
| 79 | S | F | -0.8214 | Soluble |
| 80 | R | F | -1.4638 | Soluble |
| 81 | D | F | -1.5947 | Soluble |
| 82 | T | F | -1.5102 | Soluble |
| 83 | S | F | -1.5361 | Soluble |
| 84 | K | F | -2.5009 | Soluble |
| 85 | N | F | -2.2804 | Soluble |
| 86 | Q | F | -1.7474 | Soluble |
| 87 | L | F | 0.0000 | Buried |
| 88 | S | F | -0.7131 | Soluble |
| 89 | L | F | 0.0000 | Buried |
| 90 | K | F | -1.7109 | Soluble |
| 91 | L | F | 0.0000 | Buried |
| 92 | N | F | -2.4072 | Soluble |
| 93 | S | F | -1.5617 | Soluble |
| 94 | V | F | -1.3119 | Soluble |
| 95 | T | F | -0.8413 | Soluble |
| 96 | P | F | -0.6648 | Soluble |
| 97 | A | F | -0.2941 | Soluble |
| 98 | D | F | -0.5409 | Soluble |
| 99 | T | F | -0.3385 | Soluble |
| 100 | A | F | 0.0000 | Buried |
| 101 | V | F | -0.2463 | 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 | -2.4358 | Soluble |
| 109 | R | F | -2.3319 | Soluble |
| 110 | G | F | -1.6163 | Soluble |
| 111 | Q | F | -1.1646 | Soluble |
| 111A | R | F | -0.5123 | Soluble |
| 111B | I | F | 1.0181 | Aggregation-prone |
| 111C | Y | F | 1.2884 | Aggregation-prone |
| 111D | G | F | 1.1165 | Aggregation-prone |
| 111E | V | F | 2.1238 | Aggregation-prone |
| 111F | V | F | 2.6710 | Aggregation-prone |
| 112G | S | F | 1.6272 | Aggregation-prone |
| 112F | F | F | 2.2356 | Aggregation-prone |
| 112E | G | F | 1.2625 | Aggregation-prone |
| 112D | E | F | 0.8307 | Aggregation-prone |
| 112C | F | F | 1.0959 | Aggregation-prone |
| 112B | F | F | 0.5433 | Aggregation-prone |
| 112A | Y | F | -0.0080 | Soluble |
| 112 | Y | F | 0.0000 | Buried |
| 113 | Y | F | 0.0000 | Buried |
| 114 | S | F | -0.8580 | Soluble |
| 115 | M | F | 0.0000 | Buried |
| 116 | D | F | -0.2757 | Soluble |
| 117 | V | F | 0.1322 | Aggregation-prone |
| 118 | W | F | 0.0000 | Buried |
| 119 | G | F | 0.0000 | Buried |
| 120 | K | F | -2.3797 | Soluble |
| 121 | G | F | -1.4887 | Soluble |
| 122 | T | F | -0.8760 | Soluble |
| 123 | T | F | -0.0722 | Soluble |
| 124 | V | F | 0.0000 | Buried |
| 125 | T | F | 0.0233 | Aggregation-prone |
| 126 | V | F | 0.0000 | Buried |
| 127 | S | F | -0.5171 | Soluble |
| 128 | S | F | -0.7531 | Soluble |
| 129 | A | F | -0.1795 | Soluble |
| 11 | L | I | 0.9848 | Aggregation-prone |
| 12 | S | I | 0.7198 | Aggregation-prone |
| 13 | V | I | 0.4735 | Aggregation-prone |
| 14 | A | I | 0.3797 | Aggregation-prone |
| 15 | L | I | 0.2791 | Aggregation-prone |
| 16 | G | I | -1.1409 | Soluble |
| 17 | E | I | -1.8341 | Soluble |
| 18 | T | I | -1.4171 | Soluble |
| 19 | A | I | 0.0000 | Buried |
| 20 | R | I | -1.8877 | Soluble |
| 21 | I | I | 0.0000 | Buried |
| 22 | S | I | -1.1977 | Soluble |
| 23 | C | I | 0.0000 | Buried |
| 24 | G | I | -1.3822 | Soluble |
| 25 | R | I | -1.6520 | Soluble |
| 26 | Q | I | -1.7215 | Soluble |
| 27 | A | I | -0.7547 | Soluble |
| 28 | L | I | 0.2903 | Aggregation-prone |
| 29 | G | I | 0.1685 | Aggregation-prone |
| 36 | S | I | 0.6222 | 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 | -0.3257 | Soluble |
| 44 | H | I | 0.0000 | Buried |
| 45 | R | I | -1.8866 | Soluble |
| 46 | P | I | -1.5220 | Soluble |
| 47 | G | I | -1.6718 | Soluble |
| 48 | Q | I | -2.1118 | Soluble |
| 49 | A | I | -1.1918 | Soluble |
| 50 | P | I | 0.0000 | Buried |
| 51 | I | I | 0.5860 | Aggregation-prone |
| 52 | L | I | 0.0000 | Buried |
| 53 | L | I | 0.0000 | Buried |
| 54 | I | I | 0.0000 | Buried |
| 55 | Y | I | -0.7372 | Soluble |
| 56 | N | I | -1.3679 | Soluble |
| 57 | N | I | 0.0000 | Buried |
| 65 | Q | I | -2.2474 | Soluble |
| 66 | D | I | -2.3840 | Soluble |
| 67 | R | I | -1.7750 | Soluble |
| 68 | P | I | -0.6825 | Soluble |
| 69 | S | I | -0.7353 | Soluble |
| 70 | G | I | -0.7558 | Soluble |
| 71 | I | I | -0.5984 | Soluble |
| 72 | P | I | -1.3182 | Soluble |
| 74 | E | I | -2.3244 | Soluble |
| 75 | R | I | -1.6874 | Soluble |
| 76 | F | I | 0.0000 | Buried |
| 77 | S | I | -1.2772 | Soluble |
| 78 | G | I | -1.2542 | Soluble |
| 79 | T | I | -0.6052 | Soluble |
| 80 | P | I | -0.2544 | Soluble |
| 81 | D | I | 0.1794 | Aggregation-prone |
| 81A | I | I | 1.6263 | Aggregation-prone |
| 82 | N | I | 0.3787 | Aggregation-prone |
| 83 | F | I | 1.4201 | Aggregation-prone |
| 84 | G | I | 0.1215 | Aggregation-prone |
| 85 | T | I | -0.5159 | Soluble |
| 86 | R | I | -1.6843 | Soluble |
| 87 | A | I | -1.3942 | Soluble |
| 88 | T | I | -1.0782 | Soluble |
| 89 | L | I | 0.0000 | Buried |
| 90 | T | I | -0.9894 | Soluble |
| 91 | I | I | 0.0000 | Buried |
| 92 | S | I | -1.6089 | Soluble |
| 93 | G | I | -1.2570 | Soluble |
| 94 | V | I | 0.0000 | Buried |
| 95 | E | I | -1.3654 | Soluble |
| 96 | A | I | -0.4586 | Soluble |
| 97 | G | I | -0.9895 | Soluble |
| 98 | D | I | 0.0000 | Buried |
| 99 | E | I | -1.8542 | Soluble |
| 100 | A | I | 0.0000 | Buried |
| 101 | D | I | -1.5973 | Soluble |
| 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 | 0.0000 | Buried |
| 107 | W | I | 0.0000 | Buried |
| 108 | D | I | 0.0000 | Buried |
| 109 | S | I | -0.5861 | Soluble |
| 110 | R | I | -1.7556 | Soluble |
| 112 | S | I | -0.8580 | Soluble |
| 113 | G | I | -0.3671 | Soluble |
| 114 | F | I | 0.7026 | Aggregation-prone |
| 115 | S | I | 0.3361 | Aggregation-prone |
| 116 | W | I | 0.0694 | Aggregation-prone |
| 117 | S | I | -0.3745 | Soluble |
| 118 | F | I | 0.0000 | Buried |
| 119 | G | I | -0.9684 | Soluble |
| 120 | G | I | -1.3724 | Soluble |
| 121 | A | I | -1.1843 | Soluble |
| 122 | T | I | -0.9020 | Soluble |
| 123 | R | I | -1.8380 | Soluble |
| 124 | L | I | 0.0000 | Buried |
| 125 | T | I | -0.1929 | Soluble |
| 126 | V | I | 0.0000 | Buried |
| 127 | L | I | 1.4211 | Aggregation-prone |
| 128 | G | I | 0.4244 | 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 | -0.5344 | 4.4337 | CSV PDB |
| 4.5 | -0.5748 | 4.4013 | CSV PDB |
| 5.0 | -0.6232 | 4.355 | CSV PDB |
| 5.5 | -0.6714 | 4.3027 | CSV PDB |
| 6.0 | -0.7113 | 4.253 | CSV PDB |
| 6.5 | -0.7364 | 4.2192 | CSV PDB |
| 7.0 | -0.7457 | 4.188 | CSV PDB |
| 7.5 | -0.7437 | 4.1772 | CSV PDB |
| 8.0 | -0.735 | 4.1732 | CSV PDB |
| 8.5 | -0.7211 | 4.1719 | CSV PDB |
| 9.0 | -0.7022 | 4.1715 | CSV PDB |