Project name: 3od3_M355L [mutate: MA355A]

Status: done

submitted: 2018-07-10 16:40:22, status changed: 2018-07-10 16:56:16
Settings
Chain sequence(s) A: AERRPTLPIPDLLLTTTDDARNRIQQLTIGAGQQSTFGGKTTATTWGYNGNLLGPAVKLQRGKAVTVDIYNQLTEEETTLHWHGLLEVPGEEVDGGPQGIIPPGGKRSSVTLNVDQPAATCWFHPHQHGKTGRQVAMGLAGLLVVIEDDDEILKLMMLPKQWGIDDVVPVIVQDKKFSSADGQIDYQLDVVMTAAVGWFGDTLLTNGAIYYPQHAAPRGWLRLRLLNGCNARSLNFATSDNNRPLYVIASDGGLLPEPVKVSSELPVLMGERFEVLVEVNNDNKPFDDLVTLPVSQMGMAIIAPFDKPHPVMMRRIQQQPIAISSASGALPDDTLSSSLPALPSLEGLTVRKKLQLSMDPMMLDMMMGMQMLMEKYGDQAMAGMDHSQMMGHMGHHGNMMNHMNHGGKFDFHHHANKKINGQAFDMNKPMFAAAKGQYERRWVISGVGDMMMLHPFHIHGTQFRILSENGKPPAAHRAGWKDTVKVEGNVSEEVLVVKKFNHDAPKEHAYMAHCHLLEHEDTGMMLGFTV
Distance of aggregation 10 Å
Dynamic mode No
Mutated residues MA355A
Energy difference between WT (input) and mutated protein (by FoldX) 1.84066 kcal/mol

CAUTION: Your mutation/s can destabilize the protein structure

Changes in protein stability upon mutation are calculated using the FoldX forcefield. Computational prediction of protein stability is used with the intention of preventing the experimental characterization of proteins bearing mutations that significantly destabilize their structure. Mutations resulting in a predicted reduction in protein stability ≥ 1 kcal/mol are considered disruptive.

Show buried residues

Minimal score value
-3.7395
Maximal score value
1.6484
Average score
-0.6333
Total score value
-309.0579

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
mutation
29 A A -1.0218
30 E A -2.2305
31 R A -1.6307
32 P A -0.8752
33 T A -0.4904
34 L A 0.0000
35 P A -0.0788
36 I A 0.3866
37 P A -0.3945
38 D A -1.3813
39 L A -0.1370
40 L A -0.3034
41 T A -0.8089
42 T A -1.5349
43 D A -2.0850
44 A A -1.6129
45 R A -2.6592
46 N A -2.1524
47 R A -2.6475
48 I A 0.0000
49 Q A -1.7250
50 L A 0.0000
51 T A -0.9353
52 I A 0.0000
53 G A -0.9554
54 A A -0.8441
55 G A -1.1924
56 Q A -1.6864
57 S A -1.2641
58 T A -1.2025
59 F A 0.0000
60 G A -1.0270
61 G A -1.5014
62 K A -2.3482
63 T A -1.6766
64 A A 0.0000
65 T A -0.7571
66 T A 0.0000
67 W A 0.0000
68 G A 0.0000
69 Y A 0.0000
70 N A -1.5051
71 G A -1.4794
72 N A -1.7804
73 L A -0.8248
74 L A 0.0000
75 G A -0.6393
76 P A 0.0000
77 A A 0.0000
78 V A 0.0000
79 K A -0.7922
80 L A 0.0000
81 Q A -3.2071
82 R A -3.7395
83 G A -2.9971
84 K A -2.5922
85 A A -1.9328
86 V A 0.0000
87 T A -1.3007
88 V A 0.0000
89 D A -1.4737
90 I A 0.0000
91 Y A -1.2275
92 N A 0.0000
93 Q A -1.6655
94 L A 0.0000
95 T A -0.9119
96 E A -1.1930
97 E A -1.3803
98 T A 0.0000
99 T A 0.0000
100 L A 0.0000
101 H A 0.0000
102 W A 0.0000
103 H A 0.0000
104 G A 0.0000
105 L A 0.0000
106 E A -0.9348
107 V A 0.0000
108 P A -1.4519
109 G A 0.0000
110 E A -2.3870
111 V A -0.9073
112 D A 0.0000
113 G A 0.0000
114 G A 0.0000
115 P A 0.0000
116 Q A -0.9331
117 G A -0.5645
118 I A 0.2277
119 I A 0.0000
120 P A -1.0093
121 P A -1.2125
122 G A -1.3539
123 G A -1.3249
124 K A -1.8344
125 R A -1.8014
126 S A -1.2712
127 V A -0.7079
128 T A -0.6384
129 L A 0.0000
130 N A -2.4457
131 V A 0.0000
132 D A -3.2318
133 Q A 0.0000
134 P A -1.5956
135 A A 0.0000
136 A A 0.0000
137 T A 0.0000
138 C A 0.0000
139 W A 0.0000
140 F A 0.0000
141 H A 0.0000
142 P A 0.0000
143 H A 0.0000
144 Q A 0.0000
145 H A -0.7773
146 G A -1.1228
147 K A -1.4333
148 T A 0.0000
149 G A 0.0000
150 R A -1.0505
151 Q A 0.0000
152 V A 0.0000
153 A A 0.0000
154 M A -0.2165
155 G A 0.0000
156 L A 0.0000
157 A A 0.0000
158 G A 0.0000
159 L A 0.0000
160 V A 0.0000
161 V A 0.0000
162 I A 0.0000
163 E A -1.9554
164 D A -3.0945
165 D A -3.4628
166 E A -3.1087
167 I A 0.0000
168 L A -1.0670
169 K A -1.8492
170 L A -0.4307
171 M A 0.4974
172 L A 0.0000
173 P A 0.0000
174 K A -1.6483
175 Q A -1.2947
176 W A -0.4406
177 G A 0.1381
178 I A 0.6991
179 D A 0.0000
180 D A 0.0000
181 V A 0.0000
182 P A 0.0000
183 V A 0.0000
184 I A 0.0000
185 V A 0.0000
186 Q A 0.0000
187 D A 0.0000
188 K A 0.0000
189 K A -0.7727
190 F A -0.7561
191 S A -0.7529
192 A A -1.1055
193 D A -2.1778
194 G A 0.0000
195 Q A -1.3301
196 I A -0.4971
197 D A -0.7739
198 Y A -0.4169
199 Q A -0.5007
200 L A -0.4206
201 D A -0.4674
202 V A 0.0068
203 M A 0.0000
204 T A 0.0000
205 A A 0.0000
206 A A 0.0000
207 V A 0.0000
208 G A 0.0000
209 W A 0.0000
210 F A 0.0000
211 G A 0.0000
212 D A -1.7790
213 T A -0.7629
214 L A 0.0000
215 L A 0.0000
216 T A 0.0000
217 N A 0.0000
218 G A 0.0883
219 A A 0.2881
220 I A 0.8345
221 Y A 0.3392
222 P A 0.0000
223 Q A -0.8577
224 H A 0.0000
225 A A 0.0127
226 A A 0.0000
227 P A 0.0000
228 R A -1.6160
229 G A -1.0082
230 W A -0.5424
231 L A 0.0000
232 R A 0.0000
233 L A 0.0000
234 R A 0.0000
235 L A 0.0000
236 L A 0.0000
237 N A 0.0000
238 G A 0.0000
239 C A 0.0000
240 N A 0.0000
241 A A 0.0000
242 R A 0.0000
243 S A 0.0000
244 L A 0.0000
245 N A -0.4387
246 F A 0.0000
247 A A 0.0000
248 T A 0.0000
249 S A -1.0934
250 D A -1.6638
251 N A -1.9507
252 R A 0.0000
253 P A -1.1608
254 L A 0.0000
255 Y A -0.6005
256 V A 0.0000
257 I A 0.0000
258 A A 0.0000
259 S A 0.0000
260 D A 0.0000
261 G A 0.0000
262 G A 0.0000
263 L A -0.1324
264 L A 0.0000
265 P A -1.0156
266 E A -2.1698
267 P A -1.3851
268 V A -0.8874
269 K A -1.8061
270 V A -1.0844
271 S A -1.4090
272 E A -1.7900
273 L A 0.0000
274 P A -0.4419
275 V A 0.0000
276 L A 0.0000
277 M A 0.0000
278 G A 0.0000
279 E A 0.0000
280 R A 0.0000
281 F A 0.0000
282 E A 0.0000
283 V A 0.0000
284 L A 0.0000
285 V A 0.0000
286 E A -1.0463
287 V A 0.0000
288 N A -2.7441
289 D A -2.0646
290 N A -2.5748
291 K A -2.6593
292 P A -1.7528
293 F A 0.0000
294 D A -0.8228
295 L A 0.0000
296 V A 0.0000
297 T A 0.0000
298 L A -0.7400
299 P A -0.9921
300 V A -0.4281
301 S A -0.4930
302 Q A 0.0000
303 M A 0.0000
304 G A 0.0000
305 M A 0.0000
306 A A 0.0000
307 I A -0.9302
308 A A -1.1601
309 P A -1.3572
310 F A 0.0000
311 D A -2.3935
312 K A -2.4723
313 P A -1.3254
314 H A -0.9164
315 P A -0.3080
316 V A 0.0000
317 M A 0.0000
318 R A -0.8515
319 I A 0.0000
320 Q A -1.2517
321 P A -1.1586
322 I A 0.2462
323 A A 0.3723
324 I A 1.6484
325 S A 0.1098
326 A A -0.2647
327 S A -0.4524
328 G A -0.4062
329 A A 0.0523
330 L A -0.0769
331 P A -0.8562
332 D A -2.1886
333 T A -1.5715
334 L A 0.0000
335 S A -0.9130
336 S A -0.3572
337 L A 0.0568
338 P A 0.0517
339 A A 0.2898
340 L A 0.7031
341 P A 0.0763
342 S A -0.4284
343 L A -0.4452
344 E A -1.8724
345 G A -0.9970
346 L A -0.3368
347 T A 0.0696
348 V A 0.4637
349 R A -0.6373
350 K A -1.7951
351 L A 0.0000
352 Q A -1.1131
353 L A 0.0000
354 S A -0.7251
355 A A -0.6932 mutated: MA355A
356 D A -0.5921
357 P A -0.3601
358 M A 0.5216
359 L A 0.0000
360 D A 0.0645
361 M A 0.6556
362 M A 0.3704
363 G A 0.0000
364 M A 0.0998
365 Q A 0.0000
366 M A -0.5229
367 L A 0.0000
368 M A -1.7521
369 E A -2.7807
370 K A -2.4608
371 Y A -1.2524
372 G A -1.8649
373 D A -2.3487
374 Q A -1.4906
375 A A 0.0000
376 M A 0.0000
377 A A -1.2690
378 G A -1.2142
379 M A -1.2326
380 D A -2.3454
381 H A -1.8044
382 S A -1.1389
383 Q A -0.9769
384 M A -1.0330
385 M A -0.2447
386 G A -1.1535
387 H A -0.8842
388 M A 0.0673
389 G A -0.9980
390 H A -1.8740
391 G A -1.5988
392 N A -2.0029
393 M A -0.9666
394 N A -1.6828
395 H A -1.4718
396 M A -0.5910
397 N A -1.5600
398 H A -1.7733
399 G A -1.4332
400 G A -1.6441
401 K A -1.6360
402 F A -0.1906
403 D A -1.1740
404 F A -0.5967
405 H A -1.0354
406 H A -1.8611
407 A A -1.0836
408 N A 0.0000
409 K A -1.5055
410 I A 0.0000
411 N A -1.5960
412 G A -1.4705
413 Q A -1.8737
414 A A -1.5417
415 F A 0.0000
416 D A -2.3343
417 M A -1.9896
418 N A -2.9046
419 K A -2.9855
420 P A -1.7187
421 M A -0.5640
422 F A 0.0758
423 A A -0.0276
424 A A 0.0000
425 A A -1.3698
426 K A -2.7230
427 G A -2.1940
428 Q A -1.9503
429 Y A -0.6951
430 E A 0.0000
431 R A -0.3277
432 W A 0.0000
433 V A -0.3707
434 I A 0.0000
435 S A -0.3567
436 G A 0.0000
437 V A 0.9948
438 G A -0.0875
439 D A -0.2320
440 M A -0.1681
441 M A 0.0000
442 L A 0.0000
443 H A 0.0000
444 P A 0.0000
445 F A 0.0000
446 H A 0.0000
447 I A 0.0000
448 H A 0.0000
449 G A 0.0000
450 T A 0.0000
451 Q A 0.0000
452 F A 0.0000
453 R A 0.0000
454 I A 0.0000
455 L A -0.1957
456 S A -0.8732
457 E A 0.0000
458 N A -1.2756
459 G A -1.7019
460 K A -2.1530
461 P A -1.2115
462 P A -0.7137
463 A A -0.2799
464 A A -0.3213
465 H A -0.3535
466 R A 0.0000
467 A A 0.0628
468 G A 0.0000
469 W A 0.2418
470 K A 0.0000
471 D A 0.0000
472 T A 0.0000
473 V A 0.0000
474 K A -0.9852
475 V A 0.0000
476 E A -0.8481
477 G A -0.4094
478 N A -0.7642
479 V A -0.2344
480 S A 0.0000
481 E A -0.5654
482 V A 0.0000
483 L A 0.0000
484 V A 0.0000
485 K A -1.6141
486 F A 0.0000
487 N A -2.4896
488 H A -2.0286
489 D A -2.2482
490 A A 0.0000
491 P A -1.9626
492 K A -2.9536
493 E A -3.2912
494 H A -2.2917
495 A A 0.0000
496 Y A 0.0000
497 M A 0.0000
498 A A 0.0000
499 H A 0.0000
500 C A 0.0000
501 H A 0.0000
502 L A 0.0000
503 L A 0.0000
504 E A 0.0000
505 H A 0.0000
506 E A 0.0000
507 D A -0.8698
508 T A 0.0000
509 G A 0.0000
510 M A 0.0000
511 M A 0.0000
512 L A 0.0000
513 G A 0.0000
514 F A 0.0000
515 T A -0.8615
516 V A -0.9904

 

Laboratory of Theory of Biopolymers 2015