| Chain sequence(s) |
A: FNKITPNLAEFAFSLYRQLAHQSNSTNIFFSPVSIATAFAMLSLGTKADTHDEILEGLNFNLTEIPEAQIHEGFQELLRTLNQPDSQLQLTTGNGLFLSEGLKLVDKFLEDVKKLYHSEAFTVNFGDTEEAKKQINDYVEKGTQGKIVDLVKELDRDTVFALVNYIFFKGKWERPFEVKDTEEEDFHVDQVTTVKVPMMKRLGMFNIQHCKKLSSWVLLMKYLGNATAIFFLPDEGKLQHLENELTHDIITKFLENEDRRSASLHLPKLSITGTYDLKSVLGQLGITKVFSNGADLSGVTEEAPLKLSKAVHKAVLTIDEKGTEAAGAMFLEAIPMSIPPEVKFNKPFVFLMIEQNTKSPLFMGKVVNPTQK
input PDB |
| Selected Chain(s) | A |
| Distance of aggregation | 10 Å |
| FoldX usage | Yes |
| Dynamic mode | No |
| Automated mutations | No |
| Mutated residues | EG342A |
| Energy difference between WT (input) and mutated protein (by FoldX) | 3.10996 kcal/mol
CAUTION: Your mutation/s can destabilize the protein structure |
| Downloads | Download all the data |
| Simulation log |
[INFO] Logger: Verbosity set to: 2 - [INFO] (00:00:00)
[WARNING] runJob: Working directory already exists (possibly overwriting previous results -ow
to prevent this behavior) (00:00:00)
[INFO] runJob: Starting aggrescan3d job on: input.pdb with A chain(s) selected (00:00:00)
[INFO] runJob: Creating pdb object from: input.pdb (00:00:00)
[INFO] FoldX: Starting FoldX energy minimalization (00:00:00)
[INFO] FoldX: Building mutant model (00:06:25)
[INFO] FoldX: Starting FoldX energy minimalization (00:06:39)
[INFO] Analysis: Starting Aggrescan3D on folded.pdb (00:09:16)
[INFO] Main: Simulation completed successfully. (00:09:18)
|
The table below lists A3D score for protein residues. Residues with A3D score > 0.0000 are marked by yellow rows.
| residue index | residue name | chain | Aggrescan3D score | mutation |
|---|---|---|---|---|
| residue index | residue name | chain | Aggrescan3D score | |
| 23 | F | A | 0.9676 | |
| 24 | N | A | -0.4272 | |
| 25 | K | A | -1.6827 | |
| 26 | I | A | 0.0000 | |
| 27 | T | A | 0.0000 | |
| 28 | P | A | -1.2840 | |
| 29 | N | A | -1.6255 | |
| 30 | L | A | 0.0000 | |
| 31 | A | A | 0.0000 | |
| 32 | E | A | -2.0921 | |
| 33 | F | A | 0.0000 | |
| 34 | A | A | 0.0000 | |
| 35 | F | A | 0.0000 | |
| 36 | S | A | -0.8757 | |
| 37 | L | A | 0.0000 | |
| 38 | Y | A | 0.0000 | |
| 39 | R | A | -1.2101 | |
| 40 | Q | A | -1.2078 | |
| 41 | L | A | 0.0000 | |
| 42 | A | A | -1.6526 | |
| 43 | H | A | -2.0818 | |
| 44 | Q | A | -2.1342 | |
| 45 | S | A | -1.7419 | |
| 46 | N | A | -1.9977 | |
| 47 | S | A | -0.9275 | |
| 48 | T | A | -0.9348 | |
| 49 | N | A | 0.0000 | |
| 50 | I | A | 0.0000 | |
| 51 | F | A | 0.0000 | |
| 52 | F | A | 0.0000 | |
| 53 | S | A | 0.0000 | |
| 54 | P | A | 0.0000 | |
| 55 | V | A | 0.0000 | |
| 56 | S | A | 0.0000 | |
| 57 | I | A | 0.0000 | |
| 58 | A | A | 0.0000 | |
| 59 | T | A | -0.0251 | |
| 60 | A | A | 0.0000 | |
| 61 | F | A | 0.0000 | |
| 62 | A | A | 0.0000 | |
| 63 | M | A | 0.0000 | |
| 64 | L | A | 0.0000 | |
| 65 | S | A | 0.0000 | |
| 66 | L | A | -0.1574 | |
| 67 | G | A | 0.0000 | |
| 68 | T | A | 0.0000 | |
| 69 | K | A | -2.1955 | |
| 70 | A | A | -1.8710 | |
| 71 | D | A | -2.6352 | |
| 72 | T | A | 0.0000 | |
| 73 | H | A | -2.1474 | |
| 74 | D | A | -2.6030 | |
| 75 | E | A | -2.3370 | |
| 76 | I | A | 0.0000 | |
| 77 | L | A | 0.0000 | |
| 78 | E | A | -2.5355 | |
| 79 | G | A | 0.0000 | |
| 80 | L | A | 0.0000 | |
| 81 | N | A | -1.6686 | |
| 82 | F | A | 0.0000 | |
| 83 | N | A | -2.1431 | |
| 84 | L | A | -1.5529 | |
| 85 | T | A | -1.2071 | |
| 86 | E | A | -2.1146 | |
| 87 | I | A | -1.5868 | |
| 88 | P | A | -1.4633 | |
| 89 | E | A | -2.0891 | |
| 90 | A | A | -1.5208 | |
| 91 | Q | A | -2.1989 | |
| 92 | I | A | 0.0000 | |
| 93 | H | A | -1.6339 | |
| 94 | E | A | -2.7083 | |
| 95 | G | A | 0.0000 | |
| 96 | F | A | 0.0000 | |
| 97 | Q | A | -1.7781 | |
| 98 | E | A | -2.0760 | |
| 99 | L | A | 0.0000 | |
| 100 | L | A | -1.6244 | |
| 101 | R | A | -2.6407 | |
| 102 | T | A | -2.1299 | |
| 103 | L | A | -1.7827 | |
| 104 | N | A | -2.7905 | |
| 105 | Q | A | -2.9464 | |
| 106 | P | A | -2.2487 | |
| 107 | D | A | -2.7133 | |
| 108 | S | A | -2.4667 | |
| 109 | Q | A | -2.6364 | |
| 110 | L | A | -1.5653 | |
| 111 | Q | A | -1.8042 | |
| 112 | L | A | -0.9252 | |
| 113 | T | A | -0.5861 | |
| 114 | T | A | -0.3133 | |
| 115 | G | A | -0.5196 | |
| 116 | N | A | -0.7035 | |
| 117 | G | A | 0.0000 | |
| 118 | L | A | 0.0000 | |
| 119 | F | A | 0.0000 | |
| 120 | L | A | 0.0000 | |
| 121 | S | A | -1.2523 | |
| 122 | E | A | -2.4556 | |
| 123 | G | A | -1.7901 | |
| 124 | L | A | -1.7139 | |
| 125 | K | A | -2.6805 | |
| 126 | L | A | -1.8398 | |
| 127 | V | A | -2.0090 | |
| 128 | D | A | -3.0815 | |
| 129 | K | A | -3.2522 | |
| 130 | F | A | 0.0000 | |
| 131 | L | A | -2.3385 | |
| 132 | E | A | -3.7583 | |
| 133 | D | A | -2.6087 | |
| 134 | V | A | 0.0000 | |
| 135 | K | A | -3.0749 | |
| 136 | K | A | -3.1739 | |
| 137 | L | A | -1.7644 | |
| 138 | Y | A | 0.0000 | |
| 139 | H | A | -2.6457 | |
| 140 | S | A | -2.0726 | |
| 141 | E | A | -2.0566 | |
| 142 | A | A | -0.9183 | |
| 143 | F | A | -0.1611 | |
| 144 | T | A | -0.6054 | |
| 145 | V | A | 0.0000 | |
| 146 | N | A | -2.8654 | |
| 147 | F | A | -2.6558 | |
| 148 | G | A | -2.5958 | |
| 149 | D | A | -3.2401 | |
| 150 | T | A | -3.8458 | |
| 151 | E | A | -4.3674 | |
| 152 | E | A | -4.3101 | |
| 153 | A | A | 0.0000 | |
| 154 | K | A | -3.7827 | |
| 155 | K | A | -4.0948 | |
| 156 | Q | A | -2.8503 | |
| 157 | I | A | 0.0000 | |
| 158 | N | A | 0.0000 | |
| 159 | D | A | -2.3824 | |
| 160 | Y | A | -1.6782 | |
| 161 | V | A | 0.0000 | |
| 162 | E | A | -2.2901 | |
| 163 | K | A | -2.7505 | |
| 164 | G | A | -1.9344 | |
| 165 | T | A | 0.0000 | |
| 166 | Q | A | -2.4485 | |
| 167 | G | A | -2.2818 | |
| 168 | K | A | -1.9832 | |
| 169 | I | A | 0.0000 | |
| 170 | V | A | -0.2804 | |
| 171 | D | A | -2.1152 | |
| 172 | L | A | 0.0000 | |
| 173 | V | A | 0.0000 | |
| 174 | K | A | -3.3908 | |
| 175 | E | A | -3.6622 | |
| 176 | L | A | -2.8491 | |
| 177 | D | A | -3.3027 | |
| 178 | R | A | -3.7709 | |
| 179 | D | A | -3.0673 | |
| 180 | T | A | 0.0000 | |
| 181 | V | A | -0.9189 | |
| 182 | F | A | 0.0000 | |
| 183 | A | A | 0.0000 | |
| 184 | L | A | 0.0000 | |
| 185 | V | A | 0.0000 | |
| 186 | N | A | 0.0000 | |
| 187 | Y | A | 0.0000 | |
| 188 | I | A | 0.0000 | |
| 189 | F | A | -0.4268 | |
| 190 | F | A | 0.0000 | |
| 191 | K | A | -1.2296 | |
| 192 | G | A | 0.0000 | |
| 193 | K | A | -1.7455 | |
| 194 | W | A | 0.0000 | |
| 195 | E | A | -2.5385 | |
| 196 | R | A | -1.7782 | |
| 197 | P | A | -1.6089 | |
| 198 | F | A | 0.0000 | |
| 199 | E | A | -1.5363 | |
| 200 | V | A | -0.3633 | |
| 201 | K | A | -1.8916 | |
| 202 | D | A | -1.9421 | |
| 203 | T | A | -2.2035 | |
| 204 | E | A | -3.4140 | |
| 205 | E | A | -3.5198 | |
| 206 | E | A | -2.7689 | |
| 207 | D | A | -1.7363 | |
| 208 | F | A | 0.0000 | |
| 209 | H | A | -0.9031 | |
| 210 | V | A | -0.2103 | |
| 211 | D | A | -0.9088 | |
| 212 | Q | A | -1.2243 | |
| 213 | V | A | 0.8093 | |
| 214 | T | A | 0.1816 | |
| 215 | T | A | -0.4513 | |
| 216 | V | A | -0.7739 | |
| 217 | K | A | -2.4609 | |
| 218 | V | A | 0.0000 | |
| 219 | P | A | -2.2377 | |
| 220 | M | A | 0.0000 | |
| 221 | M | A | 0.0000 | |
| 222 | K | A | -1.2200 | |
| 223 | R | A | -0.5423 | |
| 224 | L | A | 0.5506 | |
| 225 | G | A | 0.0000 | |
| 226 | M | A | -0.7588 | |
| 227 | F | A | 0.0000 | |
| 228 | N | A | -1.9194 | |
| 229 | I | A | 0.0000 | |
| 230 | Q | A | -1.0929 | |
| 231 | H | A | -0.9466 | |
| 232 | C | A | -1.4465 | |
| 233 | K | A | -2.5972 | |
| 234 | K | A | -2.6911 | |
| 235 | L | A | 0.0000 | |
| 236 | S | A | 0.0000 | |
| 237 | S | A | 0.0000 | |
| 238 | W | A | -0.3043 | |
| 239 | V | A | 0.0000 | |
| 240 | L | A | 0.0000 | |
| 241 | L | A | 0.0000 | |
| 242 | M | A | 0.0000 | |
| 243 | K | A | -1.6095 | |
| 244 | Y | A | 0.0000 | |
| 245 | L | A | -1.0575 | |
| 246 | G | A | -1.2791 | |
| 247 | N | A | -1.3718 | |
| 248 | A | A | 0.0000 | |
| 249 | T | A | 0.0000 | |
| 250 | A | A | 0.0000 | |
| 251 | I | A | 0.0000 | |
| 252 | F | A | 0.0000 | |
| 253 | F | A | 0.0000 | |
| 254 | L | A | 0.0000 | |
| 255 | P | A | 0.0000 | |
| 256 | D | A | -1.9605 | |
| 257 | E | A | -2.7018 | |
| 258 | G | A | -2.1998 | |
| 259 | K | A | -2.1919 | |
| 260 | L | A | -1.5785 | |
| 261 | Q | A | -2.1359 | |
| 262 | H | A | -2.1154 | |
| 263 | L | A | 0.0000 | |
| 264 | E | A | 0.0000 | |
| 265 | N | A | -2.1920 | |
| 266 | E | A | -1.9316 | |
| 267 | L | A | 0.0000 | |
| 268 | T | A | -1.3137 | |
| 269 | H | A | -1.7027 | |
| 270 | D | A | -2.2082 | |
| 271 | I | A | -1.4526 | |
| 272 | I | A | 0.0000 | |
| 273 | T | A | -1.6582 | |
| 274 | K | A | -2.4914 | |
| 275 | F | A | 0.0000 | |
| 276 | L | A | -1.6874 | |
| 277 | E | A | -3.1001 | |
| 278 | N | A | -3.1540 | |
| 279 | E | A | -3.4955 | |
| 280 | D | A | -3.7267 | |
| 281 | R | A | -2.7950 | |
| 282 | R | A | -2.3862 | |
| 283 | S | A | 0.0000 | |
| 284 | A | A | 0.0000 | |
| 285 | S | A | -0.4644 | |
| 286 | L | A | 0.0000 | |
| 287 | H | A | -1.1728 | |
| 288 | L | A | 0.0000 | |
| 289 | P | A | 0.0000 | |
| 290 | K | A | -1.1415 | |
| 291 | L | A | 0.0000 | |
| 292 | S | A | -0.7158 | |
| 293 | I | A | 0.0000 | |
| 294 | T | A | -0.4992 | |
| 295 | G | A | 0.0000 | |
| 296 | T | A | -0.2922 | |
| 297 | Y | A | -0.4649 | |
| 298 | D | A | -1.1008 | |
| 299 | L | A | 0.0000 | |
| 300 | K | A | -0.9446 | |
| 301 | S | A | -0.9316 | |
| 302 | V | A | 0.0000 | |
| 303 | L | A | 0.0000 | |
| 304 | G | A | -1.0722 | |
| 305 | Q | A | -1.3615 | |
| 306 | L | A | -0.9472 | |
| 307 | G | A | -1.1235 | |
| 308 | I | A | 0.0000 | |
| 309 | T | A | -0.8670 | |
| 310 | K | A | -1.7646 | |
| 311 | V | A | 0.0000 | |
| 312 | F | A | -0.7522 | |
| 313 | S | A | -1.2530 | |
| 314 | N | A | -1.8577 | |
| 315 | G | A | -1.6880 | |
| 316 | A | A | -1.7284 | |
| 317 | D | A | -1.9979 | |
| 318 | L | A | 0.0000 | |
| 319 | S | A | -1.5208 | |
| 320 | G | A | -1.1930 | |
| 321 | V | A | 0.0000 | |
| 322 | T | A | 0.0000 | |
| 323 | E | A | -3.0462 | |
| 324 | E | A | -2.9948 | |
| 325 | A | A | -1.6608 | |
| 326 | P | A | -1.2937 | |
| 327 | L | A | 0.0000 | |
| 328 | K | A | -0.9337 | |
| 329 | L | A | 0.0000 | |
| 330 | S | A | -1.0783 | |
| 331 | K | A | -0.8495 | |
| 332 | A | A | 0.0000 | |
| 333 | V | A | 0.0000 | |
| 334 | H | A | 0.0000 | |
| 335 | K | A | -0.3762 | |
| 336 | A | A | 0.0000 | |
| 337 | V | A | 0.0000 | |
| 338 | L | A | 0.0000 | |
| 339 | T | A | -0.5070 | |
| 340 | I | A | 0.0000 | |
| 341 | D | A | -0.9944 | |
| 342 | G | A | -1.3197 | mutated: EG342A |
| 343 | K | A | -1.9161 | |
| 344 | G | A | -1.5538 | |
| 345 | T | A | -1.4773 | |
| 346 | E | A | -2.0726 | |
| 347 | A | A | -1.0847 | |
| 348 | A | A | -0.6149 | |
| 349 | G | A | -0.7078 | |
| 350 | A | A | 0.3435 | |
| 351 | M | A | 1.7953 | |
| 352 | F | A | 2.2616 | |
| 353 | L | A | 2.3444 | |
| 354 | E | A | 1.1305 | |
| 355 | A | A | 0.6361 | |
| 356 | I | A | 1.0709 | |
| 357 | P | A | 0.7903 | |
| 358 | M | A | 1.5551 | |
| 359 | S | A | 1.3315 | |
| 360 | I | A | 1.8318 | |
| 361 | P | A | 0.4692 | |
| 362 | P | A | -0.7825 | |
| 363 | E | A | -1.7087 | |
| 364 | V | A | 0.0000 | |
| 365 | K | A | -1.2455 | |
| 366 | F | A | 0.0000 | |
| 367 | N | A | -0.9135 | |
| 368 | K | A | -1.2332 | |
| 369 | P | A | -0.2962 | |
| 370 | F | A | 0.0000 | |
| 371 | V | A | 0.0000 | |
| 372 | F | A | 0.0000 | |
| 373 | L | A | 0.0000 | |
| 374 | M | A | 0.0000 | |
| 375 | I | A | 0.0000 | |
| 376 | E | A | 0.0000 | |
| 377 | Q | A | -1.2363 | |
| 378 | N | A | -1.2883 | |
| 379 | T | A | 0.0000 | |
| 380 | K | A | -0.6453 | |
| 381 | S | A | 0.0000 | |
| 382 | P | A | 0.0000 | |
| 383 | L | A | 0.0000 | |
| 384 | F | A | 0.0000 | |
| 385 | M | A | 0.0000 | |
| 386 | G | A | 0.0000 | |
| 387 | K | A | 0.0000 | |
| 388 | V | A | 0.0000 | |
| 389 | V | A | -0.4062 | |
| 390 | N | A | -0.6472 | |
| 391 | P | A | 0.0000 | |
| 392 | T | A | -0.9990 | |
| 393 | Q | A | -1.3778 | |
| 394 | K | A | -1.9897 |
ALA alanine
ARG arginine
ASN asparagine
ASP aspartic acid
CYS cysteine
GLN glutamine
GLU glutamic acid
GLY glycine
HIS histidine
ILE isoleucine
LEU leucine
LYS lysine
MET methionine
PHE phenylalanine
PRO proline
SER serine
THR threonine
TRP tryptophan
TYR tyrosine
VAL valine