Calculation Parameters
| Chain Sequence(s) |
QVQLQESGPGLVKPSETLSVTCSVSGDSMNNYYWTWIRQSPGKGLEWIGYISDRESATYNPSLNSRVVISRDTSKNQLSLKLNSVTPADTAVYYCATARRGQRIYGVVSFGEFFYYYSMDVWGKGTTVTVSLSVALGETARISCGRQALGSRAVQWYQHRPGQAPILLIYNNQDRPSGIPERFSGTPDINFGTRATLTISGVEAGDEADYYCHMWDSRSGFSWSFGGATRLTVLG
input.pdb
|
| Selected Chain(s) | M (Heavy), N (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 | M | -1.4880 | Soluble |
| 2 | V | M | -0.9860 | Soluble |
| 3 | Q | M | -1.8071 | Soluble |
| 4 | L | M | -1.2748 | Soluble |
| 5 | Q | M | -1.8135 | Soluble |
| 6 | E | M | 0.0000 | Buried |
| 7 | S | M | -0.7871 | Soluble |
| 8 | G | M | -0.6158 | Soluble |
| 9 | P | M | -0.0672 | Soluble |
| 11 | G | M | 0.3514 | Aggregation-prone |
| 12 | L | M | 0.9663 | Aggregation-prone |
| 13 | V | M | 0.0000 | Buried |
| 14 | K | M | -1.9718 | Soluble |
| 15 | P | M | -1.5239 | Soluble |
| 16 | S | M | -1.7690 | Soluble |
| 17 | E | M | -2.7666 | Soluble |
| 18 | T | M | -1.9177 | Soluble |
| 19 | L | M | 0.0000 | Buried |
| 20 | S | M | -0.9358 | Soluble |
| 21 | V | M | 0.0000 | Buried |
| 22 | T | M | 0.0000 | Buried |
| 23 | C | M | 0.0000 | Buried |
| 24 | S | M | -1.1223 | Soluble |
| 25 | V | M | 0.0000 | Buried |
| 26 | S | M | -1.3207 | Soluble |
| 27 | G | M | -1.2374 | Soluble |
| 28 | D | M | -1.5762 | Soluble |
| 29 | S | M | -1.2531 | Soluble |
| 30 | M | M | -1.3706 | Soluble |
| 35 | N | M | -2.4459 | Soluble |
| 36 | N | M | -1.9893 | Soluble |
| 37 | Y | M | -1.2734 | Soluble |
| 38 | Y | M | -1.1885 | Soluble |
| 39 | W | M | 0.0000 | Buried |
| 40 | T | M | 0.0000 | Buried |
| 41 | W | M | 0.0000 | Buried |
| 42 | I | M | 0.0000 | Buried |
| 43 | R | M | 0.0000 | Buried |
| 44 | Q | M | -1.0036 | Soluble |
| 45 | S | M | -1.0643 | Soluble |
| 46 | P | M | -1.1142 | Soluble |
| 47 | G | M | -1.5229 | Soluble |
| 48 | K | M | -2.3690 | Soluble |
| 49 | G | M | -1.6749 | Soluble |
| 50 | L | M | 0.0000 | Buried |
| 51 | E | M | -1.0775 | Soluble |
| 52 | W | M | 0.0000 | Buried |
| 53 | I | M | 0.0000 | Buried |
| 54 | G | M | 0.0000 | Buried |
| 55 | Y | M | 0.1649 | Aggregation-prone |
| 56 | I | M | 0.0000 | Buried |
| 57 | S | M | -1.5383 | Soluble |
| 58 | D | M | -2.3592 | Soluble |
| 59 | R | M | -3.1143 | Soluble |
| 63 | E | M | -3.1225 | Soluble |
| 64 | S | M | -1.6906 | Soluble |
| 65 | A | M | -0.6484 | Soluble |
| 66 | T | M | -0.0925 | Soluble |
| 67 | Y | M | 0.0446 | Aggregation-prone |
| 68 | N | M | -0.4121 | Soluble |
| 69 | P | M | -0.7906 | Soluble |
| 70 | S | M | -0.8395 | Soluble |
| 71 | L | M | 0.0000 | Buried |
| 72 | N | M | -1.6816 | Soluble |
| 74 | S | M | -1.0416 | Soluble |
| 75 | R | M | -1.3566 | Soluble |
| 76 | V | M | 0.0000 | Buried |
| 77 | V | M | 0.1164 | Aggregation-prone |
| 78 | I | M | 0.0000 | Buried |
| 79 | S | M | -0.9402 | Soluble |
| 80 | R | M | -1.5492 | Soluble |
| 81 | D | M | -1.5071 | Soluble |
| 82 | T | M | -1.2672 | Soluble |
| 83 | S | M | -1.3941 | Soluble |
| 84 | K | M | -2.2619 | Soluble |
| 85 | N | M | -1.6644 | Soluble |
| 86 | Q | M | -1.4515 | Soluble |
| 87 | L | M | 0.0000 | Buried |
| 88 | S | M | -0.7880 | Soluble |
| 89 | L | M | 0.0000 | Buried |
| 90 | K | M | -1.3479 | Soluble |
| 91 | L | M | 0.0000 | Buried |
| 92 | N | M | -1.7492 | Soluble |
| 93 | S | M | -1.5055 | Soluble |
| 94 | V | M | 0.0000 | Buried |
| 95 | T | M | -0.7234 | Soluble |
| 96 | P | M | -0.4191 | Soluble |
| 97 | A | M | -0.0784 | Soluble |
| 98 | D | M | 0.0000 | Buried |
| 99 | T | M | 0.0000 | Buried |
| 100 | A | M | 0.0000 | Buried |
| 101 | V | M | -0.1958 | Soluble |
| 102 | Y | M | 0.0000 | Buried |
| 103 | Y | M | 0.0000 | Buried |
| 104 | C | M | 0.0000 | Buried |
| 105 | A | M | 0.0000 | Buried |
| 106 | T | M | 0.0000 | Buried |
| 107 | A | M | 0.0000 | Buried |
| 108 | R | M | -1.5795 | Soluble |
| 109 | R | M | -1.4746 | Soluble |
| 110 | G | M | -1.0752 | Soluble |
| 111 | Q | M | -0.8397 | Soluble |
| 111A | R | M | -0.2665 | Soluble |
| 111B | I | M | 1.2808 | Aggregation-prone |
| 111C | Y | M | 1.3512 | Aggregation-prone |
| 111D | G | M | 1.3339 | Aggregation-prone |
| 111E | V | M | 2.2923 | Aggregation-prone |
| 111F | V | M | 2.3778 | Aggregation-prone |
| 112G | S | M | 1.5120 | Aggregation-prone |
| 112F | F | M | 2.2987 | Aggregation-prone |
| 112E | G | M | 1.4236 | Aggregation-prone |
| 112D | E | M | 1.0570 | Aggregation-prone |
| 112C | F | M | 1.4220 | Aggregation-prone |
| 112B | F | M | 0.2634 | Aggregation-prone |
| 112A | Y | M | 0.0569 | Aggregation-prone |
| 112 | Y | M | 0.0000 | Buried |
| 113 | Y | M | 0.0000 | Buried |
| 114 | S | M | 0.0000 | Buried |
| 115 | M | M | 0.0000 | Buried |
| 116 | D | M | -0.4820 | Soluble |
| 117 | V | M | 0.1869 | Aggregation-prone |
| 118 | W | M | 0.0000 | Buried |
| 119 | G | M | 0.0000 | Buried |
| 120 | K | M | -2.2914 | Soluble |
| 121 | G | M | -1.3600 | Soluble |
| 122 | T | M | -0.7303 | Soluble |
| 123 | T | M | 0.0006 | Aggregation-prone |
| 124 | V | M | 0.0000 | Buried |
| 125 | T | M | 0.2388 | Aggregation-prone |
| 126 | V | M | 0.0394 | Aggregation-prone |
| 127 | S | M | -0.2038 | Soluble |
| 11 | L | N | 0.9994 | Aggregation-prone |
| 12 | S | N | 0.5463 | Aggregation-prone |
| 13 | V | N | 0.0000 | Buried |
| 14 | A | N | 0.3355 | Aggregation-prone |
| 15 | L | N | 0.8426 | Aggregation-prone |
| 16 | G | N | -0.7400 | Soluble |
| 17 | E | N | -1.5562 | Soluble |
| 18 | T | N | -1.2608 | Soluble |
| 19 | A | N | -1.0511 | Soluble |
| 20 | R | N | -1.8019 | Soluble |
| 21 | I | N | -0.7320 | Soluble |
| 22 | S | N | -1.3069 | Soluble |
| 23 | C | N | 0.0000 | Buried |
| 24 | G | N | -1.8463 | Soluble |
| 25 | R | N | -2.6281 | Soluble |
| 26 | Q | N | -2.2617 | Soluble |
| 27 | A | N | -1.1389 | Soluble |
| 28 | L | N | -0.2227 | Soluble |
| 29 | G | N | -0.0682 | Soluble |
| 36 | S | N | 0.2990 | Aggregation-prone |
| 37 | R | N | 0.0000 | Buried |
| 38 | A | N | 0.0000 | Buried |
| 39 | V | N | 0.0000 | Buried |
| 40 | Q | N | 0.0000 | Buried |
| 41 | W | N | 0.0000 | Buried |
| 42 | Y | N | 0.0000 | Buried |
| 43 | Q | N | 0.0000 | Buried |
| 44 | H | N | 0.0000 | Buried |
| 45 | R | N | -1.1993 | Soluble |
| 46 | P | N | -1.2115 | Soluble |
| 47 | G | N | -1.5766 | Soluble |
| 48 | Q | N | -1.9766 | Soluble |
| 49 | A | N | -0.9653 | Soluble |
| 50 | P | N | 0.0000 | Buried |
| 51 | I | N | 0.9416 | Aggregation-prone |
| 52 | L | N | 0.0000 | Buried |
| 53 | L | N | 0.0000 | Buried |
| 54 | I | N | 0.0000 | Buried |
| 55 | Y | N | -1.0881 | Soluble |
| 56 | N | N | -1.5142 | Soluble |
| 57 | N | N | 0.0000 | Buried |
| 65 | Q | N | -2.5917 | Soluble |
| 66 | D | N | -3.3615 | Soluble |
| 67 | R | N | -3.1631 | Soluble |
| 68 | P | N | 0.0000 | Buried |
| 69 | S | N | -1.0573 | Soluble |
| 70 | G | N | -0.8278 | Soluble |
| 71 | I | N | -1.0855 | Soluble |
| 72 | P | N | -1.6100 | Soluble |
| 74 | E | N | -2.7831 | Soluble |
| 75 | R | N | -1.6591 | Soluble |
| 76 | F | N | 0.0000 | Buried |
| 77 | S | N | -1.8332 | Soluble |
| 78 | G | N | -1.4901 | Soluble |
| 79 | T | N | -0.6417 | Soluble |
| 80 | P | N | -0.7956 | Soluble |
| 81 | D | N | -0.2264 | Soluble |
| 81A | I | N | 1.4201 | Aggregation-prone |
| 82 | N | N | 0.3461 | Aggregation-prone |
| 83 | F | N | 1.1970 | Aggregation-prone |
| 84 | G | N | -0.0771 | Soluble |
| 85 | T | N | -0.7630 | Soluble |
| 86 | R | N | -2.2681 | Soluble |
| 87 | A | N | 0.0000 | Buried |
| 88 | T | N | -1.0405 | Soluble |
| 89 | L | N | 0.0000 | Buried |
| 90 | T | N | 0.0000 | Buried |
| 91 | I | N | 0.0000 | Buried |
| 92 | S | N | -1.2717 | Soluble |
| 93 | G | N | -0.8723 | Soluble |
| 94 | V | N | -0.8476 | Soluble |
| 95 | E | N | -2.0354 | Soluble |
| 96 | A | N | -1.4707 | Soluble |
| 97 | G | N | -1.2452 | Soluble |
| 98 | D | N | 0.0000 | Buried |
| 99 | E | N | -2.6477 | Soluble |
| 100 | A | N | 0.0000 | Buried |
| 101 | D | N | 0.0000 | Buried |
| 102 | Y | N | 0.0000 | Buried |
| 103 | Y | N | 0.0000 | Buried |
| 104 | C | N | -0.3792 | Soluble |
| 105 | H | N | 0.0000 | Buried |
| 106 | M | N | 0.0000 | Buried |
| 107 | W | N | 0.0000 | Buried |
| 108 | D | N | 0.0000 | Buried |
| 109 | S | N | -0.5687 | Soluble |
| 110 | R | N | -1.7521 | Soluble |
| 112 | S | N | -0.8923 | Soluble |
| 113 | G | N | -0.3379 | Soluble |
| 114 | F | N | 0.3984 | Aggregation-prone |
| 115 | S | N | 0.3100 | Aggregation-prone |
| 116 | W | N | 0.3841 | Aggregation-prone |
| 117 | S | N | -0.2727 | Soluble |
| 118 | F | N | 0.0000 | Buried |
| 119 | G | N | -1.0281 | Soluble |
| 120 | G | N | -1.2176 | Soluble |
| 121 | A | N | -0.8606 | Soluble |
| 122 | T | N | -0.8743 | Soluble |
| 123 | R | N | -1.7955 | Soluble |
| 124 | L | N | 0.0000 | Buried |
| 125 | T | N | -0.1382 | Soluble |
| 126 | V | N | 0.7980 | Aggregation-prone |
| 127 | L | N | 1.7809 | Aggregation-prone |
| 128 | G | N | 0.5969 | 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 | -0.4767 | 4.4889 | CSV PDB |
| 4.5 | -0.5078 | 4.4721 | CSV PDB |
| 5.0 | -0.5498 | 4.4475 | CSV PDB |
| 5.5 | -0.5946 | 4.4193 | CSV PDB |
| 6.0 | -0.6331 | 4.3918 | CSV PDB |
| 6.5 | -0.6583 | 4.3695 | CSV PDB |
| 7.0 | -0.6677 | 4.3557 | CSV PDB |
| 7.5 | -0.6646 | 4.3494 | CSV PDB |
| 8.0 | -0.6544 | 4.347 | CSV PDB |
| 8.5 | -0.6404 | 4.3463 | CSV PDB |
| 9.0 | -0.6237 | 4.346 | CSV PDB |