Calculation Parameters
| Chain Sequence(s) |
QVQLQESGPGLVKPSETLSVTCSVSGDSMNNYYWTWIRQSPGKGLEWIGYISDRESATYNPSLNSRVVISRDTSKNQLSLKLNSVTPADTAVYYCATARRGQRIYGVVSFGEFFYYYSMDVWGKGTTVTVSSALSVALGETARISCGRQALGSRAVQWYQHRPGQAPILLIYNNQDRPSGIPERFSGTPDINFGTRATLTISGVEAGDEADYYCHMWDSRSGFSWSFGGATRLTVLG
input.pdb
|
| Selected Chain(s) | O (Heavy), R (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 | O | -1.7103 | Soluble |
| 2 | V | O | 0.0000 | Buried |
| 3 | Q | O | -1.9130 | Soluble |
| 4 | L | O | 0.0000 | Buried |
| 5 | Q | O | -2.0323 | Soluble |
| 6 | E | O | -1.3873 | Soluble |
| 7 | S | O | -0.8711 | Soluble |
| 8 | G | O | -0.5515 | Soluble |
| 9 | P | O | -0.2582 | Soluble |
| 11 | G | O | 0.1528 | Aggregation-prone |
| 12 | L | O | 0.6761 | Aggregation-prone |
| 13 | V | O | 0.0000 | Buried |
| 14 | K | O | -1.1494 | Soluble |
| 15 | P | O | -1.0684 | Soluble |
| 16 | S | O | -1.2153 | Soluble |
| 17 | E | O | -1.7455 | Soluble |
| 18 | T | O | -1.3474 | Soluble |
| 19 | L | O | 0.0000 | Buried |
| 20 | S | O | -0.9504 | Soluble |
| 21 | V | O | 0.0000 | Buried |
| 22 | T | O | -0.7377 | Soluble |
| 23 | C | O | 0.0000 | Buried |
| 24 | S | O | -1.2468 | Soluble |
| 25 | V | O | 0.0000 | Buried |
| 26 | S | O | -1.5780 | Soluble |
| 27 | G | O | -1.6979 | Soluble |
| 28 | D | O | -2.2208 | Soluble |
| 29 | S | O | -1.5023 | Soluble |
| 30 | M | O | 0.0000 | Buried |
| 35 | N | O | -2.3104 | Soluble |
| 36 | N | O | -2.3940 | Soluble |
| 37 | Y | O | -1.3407 | Soluble |
| 38 | Y | O | -0.8927 | Soluble |
| 39 | W | O | 0.0000 | Buried |
| 40 | T | O | 0.0000 | Buried |
| 41 | W | O | 0.0000 | Buried |
| 42 | I | O | 0.0000 | Buried |
| 43 | R | O | -0.5632 | Soluble |
| 44 | Q | O | 0.0000 | Buried |
| 45 | S | O | -0.9875 | Soluble |
| 46 | P | O | -1.1402 | Soluble |
| 47 | G | O | -1.4758 | Soluble |
| 48 | K | O | -2.1965 | Soluble |
| 49 | G | O | -1.3538 | Soluble |
| 50 | L | O | 0.0000 | Buried |
| 51 | E | O | -0.8404 | Soluble |
| 52 | W | O | 0.0000 | Buried |
| 53 | I | O | 0.0000 | Buried |
| 54 | G | O | 0.0000 | Buried |
| 55 | Y | O | 0.0541 | Aggregation-prone |
| 56 | I | O | 0.0000 | Buried |
| 57 | S | O | 0.0000 | Buried |
| 58 | D | O | -3.5425 | Soluble |
| 59 | R | O | -3.5261 | Soluble |
| 63 | E | O | -3.2808 | Soluble |
| 64 | S | O | -1.7575 | Soluble |
| 65 | A | O | -0.5767 | Soluble |
| 66 | T | O | -0.2707 | Soluble |
| 67 | Y | O | -0.2730 | Soluble |
| 68 | N | O | 0.0000 | Buried |
| 69 | P | O | -0.8170 | Soluble |
| 70 | S | O | -0.7985 | Soluble |
| 71 | L | O | 0.0000 | Buried |
| 72 | N | O | -1.7041 | Soluble |
| 74 | S | O | -1.0257 | Soluble |
| 75 | R | O | -1.3658 | Soluble |
| 76 | V | O | 0.0000 | Buried |
| 77 | V | O | -0.0783 | Soluble |
| 78 | I | O | 0.0000 | Buried |
| 79 | S | O | -0.7253 | Soluble |
| 80 | R | O | -1.4757 | Soluble |
| 81 | D | O | -1.6344 | Soluble |
| 82 | T | O | -1.6507 | Soluble |
| 83 | S | O | -1.5024 | Soluble |
| 84 | K | O | -2.2969 | Soluble |
| 85 | N | O | -1.8588 | Soluble |
| 86 | Q | O | -1.4411 | Soluble |
| 87 | L | O | 0.0000 | Buried |
| 88 | S | O | -0.6612 | Soluble |
| 89 | L | O | 0.0000 | Buried |
| 90 | K | O | -1.3613 | Soluble |
| 91 | L | O | 0.0000 | Buried |
| 92 | N | O | -1.4795 | Soluble |
| 93 | S | O | -1.1897 | Soluble |
| 94 | V | O | 0.0000 | Buried |
| 95 | T | O | -0.6043 | Soluble |
| 96 | P | O | -0.5307 | Soluble |
| 97 | A | O | -0.0430 | Soluble |
| 98 | D | O | 0.0000 | Buried |
| 99 | T | O | 0.0656 | Aggregation-prone |
| 100 | A | O | 0.0000 | Buried |
| 101 | V | O | -0.2516 | Soluble |
| 102 | Y | O | 0.0000 | Buried |
| 103 | Y | O | 0.0000 | Buried |
| 104 | C | O | 0.0000 | Buried |
| 105 | A | O | 0.0000 | Buried |
| 106 | T | O | 0.0000 | Buried |
| 107 | A | O | 0.0000 | Buried |
| 108 | R | O | -1.8362 | Soluble |
| 109 | R | O | -1.9976 | Soluble |
| 110 | G | O | -1.1928 | Soluble |
| 111 | Q | O | -0.5124 | Soluble |
| 111A | R | O | 0.1995 | Aggregation-prone |
| 111B | I | O | 1.7985 | Aggregation-prone |
| 111C | Y | O | 1.5739 | Aggregation-prone |
| 111D | G | O | 1.3513 | Aggregation-prone |
| 111E | V | O | 2.1873 | Aggregation-prone |
| 111F | V | O | 2.4466 | Aggregation-prone |
| 112G | S | O | 1.4486 | Aggregation-prone |
| 112F | F | O | 2.1374 | Aggregation-prone |
| 112E | G | O | 1.1789 | Aggregation-prone |
| 112D | E | O | 1.0460 | Aggregation-prone |
| 112C | F | O | 1.4030 | Aggregation-prone |
| 112B | F | O | 0.4296 | Aggregation-prone |
| 112A | Y | O | 0.0906 | Aggregation-prone |
| 112 | Y | O | -0.2560 | Soluble |
| 113 | Y | O | 0.0000 | Buried |
| 114 | S | O | 0.0000 | Buried |
| 115 | M | O | 0.0000 | Buried |
| 116 | D | O | -0.2371 | Soluble |
| 117 | V | O | 0.1024 | Aggregation-prone |
| 118 | W | O | 0.0000 | Buried |
| 119 | G | O | 0.0000 | Buried |
| 120 | K | O | -2.3645 | Soluble |
| 121 | G | O | 0.0000 | Buried |
| 122 | T | O | -0.7827 | Soluble |
| 123 | T | O | -0.2591 | Soluble |
| 124 | V | O | 0.0000 | Buried |
| 125 | T | O | 0.1779 | Aggregation-prone |
| 126 | V | O | 0.0829 | Aggregation-prone |
| 127 | S | O | -0.1070 | Soluble |
| 128 | S | O | -0.2599 | Soluble |
| 129 | A | O | -0.0633 | Soluble |
| 11 | L | R | 1.0248 | Aggregation-prone |
| 12 | S | R | 0.6888 | Aggregation-prone |
| 13 | V | R | 0.0000 | Buried |
| 14 | A | R | 0.2200 | Aggregation-prone |
| 15 | L | R | 0.0467 | Aggregation-prone |
| 16 | G | R | -1.2072 | Soluble |
| 17 | E | R | -1.7548 | Soluble |
| 18 | T | R | -1.3701 | Soluble |
| 19 | A | R | 0.0000 | Buried |
| 20 | R | R | -1.7560 | Soluble |
| 21 | I | R | 0.0000 | Buried |
| 22 | S | R | -1.0604 | Soluble |
| 23 | C | R | -0.8701 | Soluble |
| 24 | G | R | -1.1639 | Soluble |
| 25 | R | R | -1.4956 | Soluble |
| 26 | Q | R | -1.6710 | Soluble |
| 27 | A | R | -0.7255 | Soluble |
| 28 | L | R | 0.1801 | Aggregation-prone |
| 29 | G | R | 0.1192 | Aggregation-prone |
| 36 | S | R | 0.6415 | Aggregation-prone |
| 37 | R | R | 0.0000 | Buried |
| 38 | A | R | 0.0000 | Buried |
| 39 | V | R | 0.0000 | Buried |
| 40 | Q | R | 0.0000 | Buried |
| 41 | W | R | 0.0000 | Buried |
| 42 | Y | R | 0.0000 | Buried |
| 43 | Q | R | -0.5174 | Soluble |
| 44 | H | R | 0.0000 | Buried |
| 45 | R | R | -2.3780 | Soluble |
| 46 | P | R | -1.9879 | Soluble |
| 47 | G | R | -1.7946 | Soluble |
| 48 | Q | R | -2.2889 | Soluble |
| 49 | A | R | -1.4077 | Soluble |
| 50 | P | R | 0.0000 | Buried |
| 51 | I | R | 0.5929 | Aggregation-prone |
| 52 | L | R | 0.0000 | Buried |
| 53 | L | R | 0.0000 | Buried |
| 54 | I | R | 0.0000 | Buried |
| 55 | Y | R | -0.8560 | Soluble |
| 56 | N | R | -1.2283 | Soluble |
| 57 | N | R | 0.0000 | Buried |
| 65 | Q | R | -2.0806 | Soluble |
| 66 | D | R | -2.1465 | Soluble |
| 67 | R | R | -1.7822 | Soluble |
| 68 | P | R | -0.8577 | Soluble |
| 69 | S | R | -0.6181 | Soluble |
| 70 | G | R | -0.4983 | Soluble |
| 71 | I | R | -0.8040 | Soluble |
| 72 | P | R | -1.3468 | Soluble |
| 74 | E | R | -2.1365 | Soluble |
| 75 | R | R | -1.5546 | Soluble |
| 76 | F | R | 0.0000 | Buried |
| 77 | S | R | -1.4370 | Soluble |
| 78 | G | R | -1.2747 | Soluble |
| 79 | T | R | -0.7314 | Soluble |
| 80 | P | R | -0.4549 | Soluble |
| 81 | D | R | 0.1860 | Aggregation-prone |
| 81A | I | R | 1.6672 | Aggregation-prone |
| 82 | N | R | 0.3979 | Aggregation-prone |
| 83 | F | R | 1.4360 | Aggregation-prone |
| 84 | G | R | 0.1407 | Aggregation-prone |
| 85 | T | R | -0.5421 | Soluble |
| 86 | R | R | -1.6955 | Soluble |
| 87 | A | R | 0.0000 | Buried |
| 88 | T | R | -0.9599 | Soluble |
| 89 | L | R | 0.0000 | Buried |
| 90 | T | R | -0.9765 | Soluble |
| 91 | I | R | 0.0000 | Buried |
| 92 | S | R | -1.5927 | Soluble |
| 93 | G | R | -1.3567 | Soluble |
| 94 | V | R | 0.0000 | Buried |
| 95 | E | R | -2.2963 | Soluble |
| 96 | A | R | -1.1613 | Soluble |
| 97 | G | R | -1.4746 | Soluble |
| 98 | D | R | 0.0000 | Buried |
| 99 | E | R | -2.7478 | Soluble |
| 100 | A | R | 0.0000 | Buried |
| 101 | D | R | 0.0000 | Buried |
| 102 | Y | R | 0.0000 | Buried |
| 103 | Y | R | 0.0000 | Buried |
| 104 | C | R | 0.0000 | Buried |
| 105 | H | R | 0.0000 | Buried |
| 106 | M | R | 0.0000 | Buried |
| 107 | W | R | 0.0000 | Buried |
| 108 | D | R | 0.0000 | Buried |
| 109 | S | R | -0.4173 | Soluble |
| 110 | R | R | -1.6935 | Soluble |
| 112 | S | R | -0.9049 | Soluble |
| 113 | G | R | -0.4691 | Soluble |
| 114 | F | R | 0.7435 | Aggregation-prone |
| 115 | S | R | 0.3610 | Aggregation-prone |
| 116 | W | R | 0.1501 | Aggregation-prone |
| 117 | S | R | -0.2710 | Soluble |
| 118 | F | R | 0.0000 | Buried |
| 119 | G | R | -0.6857 | Soluble |
| 120 | G | R | -1.1189 | Soluble |
| 121 | A | R | -0.9985 | Soluble |
| 122 | T | R | -0.8675 | Soluble |
| 123 | R | R | -2.0708 | Soluble |
| 124 | L | R | 0.0000 | Buried |
| 125 | T | R | -0.2334 | Soluble |
| 126 | V | R | 0.0965 | Aggregation-prone |
| 127 | L | R | 1.4565 | Aggregation-prone |
| 128 | G | R | 0.4437 | 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 | -0.3792 | 4.3355 | CSV PDB |
| 4.5 | -0.4125 | 4.3126 | CSV PDB |
| 5.0 | -0.4546 | 4.277 | CSV PDB |
| 5.5 | -0.4983 | 4.2419 | CSV PDB |
| 6.0 | -0.5357 | 4.2174 | CSV PDB |
| 6.5 | -0.5608 | 4.1931 | CSV PDB |
| 7.0 | -0.5716 | 4.1692 | CSV PDB |
| 7.5 | -0.572 | 4.1465 | CSV PDB |
| 8.0 | -0.5663 | 4.127 | CSV PDB |
| 8.5 | -0.5565 | 4.1141 | CSV PDB |
| 9.0 | -0.5428 | 4.1136 | CSV PDB |