Project name: V527E [mutate: VA527E]

Status: done

submitted: 2018-10-05 12:38:20, status changed: 2018-10-05 13:24:17
Settings
Chain sequence(s) A: AGIRVTKVDWQRSRNGAAHHTQEYPCPELVVRRGQSFSLTLELSRALDCEEILIFTMETGPRASEALHTKAVFQTSELERGEGWTAAREAQMEKTLTVSLASPPSAVIGRYLLSIRLSSHRKHSNRRLGEFVLLFNPWCAEDDVFLASEEERQEYVLSDSGIIFRGVEKHIRAQGWNYGQFEEDILNICLSILDRSPGHQNNPATDVSCRHNPIYVTRVISAMVNSNNDRGVVQGQWQGKYGGGTSPLHWRGSVAILQKWLKGRYKPVKYGQCWVFAGVLCTVLRCLGIATRVVSNFNSAHDTDQNLSVDKYVDSFGRTLEDLTEDSMWNFHVWNESWFARQDLGPSYNGWQVLDATPQEESEGVFRCGPASVTAIREGDVHLAHDGPFVFAEVNADYITWLWHEDESRERVYSNTKKIGRCISTKAVGSDSRVDITDLYKYPEGSRKERQVYSKAVNRLFGVEASGRRIWIRRAGGRCLWRDDLLEPATKPSIAGKFKVLEPPMLGHDLRLALCLANLTSRAQRVRVNLSGATILYTRKPVAEILHESHAVRLGPQEEKRIPITISYSKYKEDLTEDKKILLAAMCLVTKGEKLLVEKDITLEDFITIKVLGPAMVGVAVTVEVTVVNPLIERVKDCALMVEGSGLLQEQLSIDVPTLEPQERASVQFDITPSKSGPRQLQVDLVSPHFPDIKGFVIVHVAT
B: AGIRVTKVDWQRSRNGAAHHTQEYPCPELVVRRGQSFSLTLELSRALDCEEILIFTMETGPRASEALHTKAVFQTSELERGEGWTAAREAQMEKTLTVSLASPPSAVIGRYLLSIRLSSHRKHSNRRLGEFVLLFNPWCAEDDVFLASEEERQEYVLSDSGIIFRGVEKHIRAQGWNYGQFEEDILNICLSILDRSPGHQNNPATDVSCRHNPIYVTRVISAMVNSNNDRGVVQGQWQGKYGGGTSPLHWRGSVAILQKWLKGRYKPVKYGQCWVFAGVLCTVLRCLGIATRVVSNFNSAHDTDQNLSVDKYVDSFGRTLEDLTEDSMWNFHVWNESWFARQDLGPSYNGWQVLDATPQEESEGVFRCGPASVTAIREGDVHLAHDGPFVFAEVNADYITWLWHEDESRERVYSNTKKIGRCISTKAVGSDSRVDITDLYKYPEGSRKERQVYSKAVNRLFGVEASGRRIWIRRAGGRCLWRDDLLEPATKPSIAGKFKVLEPPMLGHDLRLALCLANLTSRAQRVRVNLSGATILYTRKPVAEILHESHAVRLGPQEEKRIPITISYSKYKEDLTEDKKILLAAMCLVTKGEKLLVEKDITLEDFITIKVLGPAMVGVAVTVEVTVVNPLIERVKDCALMVEGSGLLQEQLSIDVPTLEPQERASVQFDITPSKSGPRQLQVDLVSPHFPDIKGFVIVHVAT
Distance of aggregation 10 Å
Dynamic mode No
Mutated residues VA527E
Energy difference between WT (input) and mutated protein (by FoldX) 3.93167 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
-4.1258
Maximal score value
2.2457
Average score
-0.8144
Total score value
-1145.1021

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
2 A A -0.7595
3 G A -1.3896
4 I A 0.0000
5 R A -2.6720
6 V A -2.2670
7 T A -1.7329
8 K A -2.4479
9 V A -1.5954
10 D A -2.4471
11 W A -1.8401
12 Q A -2.1573
13 R A -3.1011
14 S A -2.2666
15 R A -2.6767
16 N A 0.0000
17 G A 0.0000
18 A A -1.4594
19 A A -0.9533
20 H A 0.0000
21 H A -0.6652
22 T A 0.0000
23 Q A -2.0251
24 E A -1.2440
25 Y A 0.0000
26 P A -1.1982
27 C A -1.0781
28 P A -0.9617
29 E A -1.2629
30 L A 0.0000
31 V A 0.0000
32 V A 0.0000
33 R A 0.0000
34 R A 0.0000
35 G A -0.8011
36 Q A -0.3925
37 S A -0.3011
38 F A 0.0000
39 S A -1.0928
40 L A 0.0000
41 T A -1.1961
42 L A 0.0000
43 E A -2.7869
44 L A 0.0000
45 S A -1.8222
46 R A -1.8018
47 A A -1.4105
48 L A -0.9823
49 D A -0.8972
50 C A -0.3528
51 E A -1.6789
52 E A 0.0000
53 I A -0.4057
54 L A 0.0000
55 I A 0.0000
56 F A 0.0000
57 T A 0.0000
58 M A 0.0000
59 E A -1.1535
60 T A 0.0000
61 G A -1.0254
62 P A -0.8196
63 R A -1.0032
64 A A 0.0000
65 S A 0.0000
66 E A -0.8495
67 A A -0.3522
68 L A -0.0848
69 H A -0.7941
70 T A 0.0000
71 K A -0.7851
72 A A -0.3732
73 V A -0.1624
74 F A 0.0000
75 Q A -0.5801
76 T A 0.0000
77 S A -0.9535
78 E A -2.0008
79 L A -1.4139
80 E A -2.7175
81 R A -2.7952
82 G A -2.4538
83 E A -2.6702
84 G A -1.3354
85 W A -0.8061
86 T A 0.0000
87 A A 0.0000
88 A A -1.3305
89 R A -1.7649
90 E A -2.1575
91 A A -1.4359
92 Q A -2.0730
93 M A -1.2060
94 E A -2.5627
95 K A -2.5890
96 T A -1.9275
97 L A 0.0000
98 T A -1.3839
99 V A 0.0000
100 S A -0.5127
101 L A 0.0000
102 A A 0.0000
103 S A 0.0000
104 P A 0.0000
105 P A -1.0031
106 S A -0.8018
107 A A 0.0000
108 V A 0.0000
109 I A 0.0000
110 G A 0.0000
111 R A -1.2690
112 Y A 0.0000
113 L A -1.2013
114 L A 0.0000
115 S A -1.9104
116 I A 0.0000
117 R A -1.6117
118 L A 0.0000
119 S A 0.0000
120 S A 0.0000
121 H A -1.7303
122 R A -1.3691
123 K A -1.1294
124 H A -0.8449
125 S A -1.4905
126 N A -2.6567
127 R A -3.5002
128 R A -3.1381
129 L A -2.0019
130 G A -1.5405
131 E A -2.2709
132 F A 0.0000
133 V A 0.0000
134 L A 0.0000
135 L A 0.0000
136 F A 0.0000
137 N A 0.0000
138 P A 0.0000
139 W A -0.1250
140 C A -0.2791
141 A A -0.5953
142 E A -1.7310
143 D A 0.0000
144 D A -0.9575
145 V A 0.0000
146 F A 0.2394
147 L A 0.0000
148 A A -0.5385
149 S A -1.7399
150 E A -3.2367
151 E A -3.3849
152 E A -2.4409
153 R A 0.0000
154 Q A -2.4515
155 E A 0.0000
156 Y A 0.0000
157 V A 0.0000
158 L A -0.6209
159 S A -0.3105
160 D A 0.0000
161 S A -0.2829
162 G A 0.0000
163 I A 0.0000
164 I A 0.0000
165 F A 0.0000
166 R A -0.3239
167 G A 0.0000
168 V A 0.0000
169 E A -1.4124
170 K A -2.1153
171 H A -1.3576
172 I A -0.5854
173 R A -0.8515
174 A A -0.5513
175 Q A 0.0000
176 G A 0.0000
177 W A 0.0000
178 N A 0.0000
179 Y A 0.0000
180 G A 0.0000
181 Q A 0.0000
182 F A -0.6850
183 E A -1.7553
184 E A -2.6150
185 D A -1.5256
186 I A 0.0000
187 L A 0.0000
188 N A -0.9272
189 I A 0.0000
190 C A 0.0000
191 L A 0.0000
192 S A -0.9519
193 I A 0.0000
194 L A 0.0000
195 D A -2.2082
196 R A -2.7413
197 S A 0.0000
198 P A -2.0309
199 G A -1.6842
200 H A -2.2704
201 Q A -2.7805
202 N A -2.4172
203 N A -2.0823
204 P A -1.7690
205 A A -0.8441
206 T A -0.5474
207 D A 0.0000
208 V A 0.0000
209 S A -0.2310
210 C A -0.0227
211 R A 0.0000
212 H A -0.6368
213 N A -0.5939
214 P A 0.0000
215 I A -0.2070
216 Y A 0.2372
217 V A 0.0000
218 T A 0.0000
219 R A 0.0000
220 V A 0.0000
221 I A 0.0000
222 S A 0.0000
223 A A 0.0000
224 M A 0.0000
225 V A 0.0000
226 N A 0.0000
227 S A -1.6744
228 N A -1.4409
229 N A -1.9578
230 D A -2.1981
231 R A -3.0374
232 G A 0.0000
233 V A 0.0000
234 V A 0.0000
235 Q A -1.1669
236 G A 0.0000
237 Q A -0.9212
238 W A -0.9479
239 Q A -1.7792
240 G A -1.5169
241 K A -2.1897
242 Y A -1.5165
243 G A -1.3290
244 G A -1.1852
245 G A -1.2608
246 T A -0.7701
247 S A -0.6583
248 P A 0.0000
249 L A 0.0000
250 H A -0.0898
251 W A 0.0000
252 R A 0.0000
253 G A 0.0000
254 S A 0.0000
255 V A 0.0000
256 A A -0.8415
257 I A 0.0000
258 L A 0.0000
259 Q A -1.5952
260 K A -2.3483
261 W A 0.0000
262 L A -1.7873
263 K A -2.8395
264 G A -2.5748
265 R A -2.9279
266 Y A -2.5996
267 K A -3.1667
268 P A -2.0577
269 V A 0.0000
270 K A -1.5865
271 Y A 0.0000
272 G A 0.0000
273 Q A 0.0000
274 C A 0.0000
275 W A 0.0000
276 V A 0.0000
277 F A 0.0000
278 A A 0.0000
279 G A 0.0000
280 V A 0.0000
281 L A 0.0000
282 C A 0.0000
283 T A 0.0000
284 V A 0.0000
285 L A 0.0000
286 R A 0.0000
287 C A 0.0000
288 L A 0.0000
289 G A 0.0000
290 I A 0.0000
291 A A 0.0000
292 T A 0.0000
293 R A 0.0000
294 V A 0.0000
295 V A 0.0000
296 S A 0.0000
297 N A 0.0000
298 F A 0.0000
299 N A 0.0000
300 S A 0.0000
301 A A 0.0000
302 H A -0.8325
303 D A 0.0000
304 T A -2.0493
305 D A -2.7114
306 Q A -1.8738
307 N A -1.3752
308 L A 0.0000
309 S A -0.7553
310 V A 0.0000
311 D A -0.6268
312 K A 0.0000
313 Y A -0.6683
314 V A 0.0000
315 D A -0.5051
316 S A 0.0004
317 F A 0.4413
318 G A 0.0000
319 R A -0.5693
320 T A 0.0000
321 L A -0.6465
322 E A -1.5686
323 D A -2.1150
324 L A -0.8968
325 T A -1.3248
326 E A -2.4300
327 D A 0.0000
328 S A -0.7105
329 M A -0.1047
330 W A 0.0000
331 N A 0.0000
332 F A 0.0000
333 H A 0.0000
334 V A 0.0000
335 W A 0.0000
336 N A 0.0000
337 E A 0.0000
338 S A 0.0000
339 W A 0.1483
340 F A 0.0000
341 A A -1.0564
342 R A 0.0000
343 Q A -2.3273
344 D A -2.3405
345 L A -1.1898
346 G A -1.2315
347 P A -1.0972
348 S A -0.7154
349 Y A -0.8637
350 N A -1.5749
351 G A 0.0000
352 W A 0.0422
353 Q A 0.0000
354 V A 0.0000
355 L A 0.0000
356 D A 0.0000
357 A A 0.0000
358 T A 0.0000
359 P A -0.5712
360 Q A -0.7694
361 E A -1.6541
362 E A -2.5451
363 S A 0.0000
364 E A -2.4634
365 G A -1.9405
366 V A -1.4900
367 F A -1.2526
368 R A -0.9689
369 C A 0.0000
370 G A 0.0000
371 P A 0.0000
372 A A 0.0000
373 S A 0.0000
374 V A 0.0000
375 T A -0.3052
376 A A 0.0000
377 I A 0.0000
378 R A -0.6666
379 E A -0.9402
380 G A 0.0000
381 D A -0.8054
382 V A 0.0000
383 H A -1.0304
384 L A -0.3458
385 A A -0.4306
386 H A -0.3261
387 D A -0.9441
388 G A 0.0000
389 P A -0.5896
390 F A 0.0000
391 V A 0.0000
392 F A 0.0000
393 A A 0.0000
394 E A 0.0000
395 V A 0.0000
396 N A 0.0000
397 A A 0.0000
398 D A -0.6091
399 Y A 0.0000
400 I A -0.1033
401 T A 0.0000
402 W A -1.1456
403 L A 0.0000
404 W A -2.3154
405 H A -3.0037
406 E A -3.7841
407 D A -3.8954
408 E A -3.7968
409 S A -3.3071
410 R A -4.0530
411 E A -3.7116
412 R A -2.8637
413 V A -0.9361
414 Y A -0.0336
415 S A -0.3425
416 N A -0.6537
417 T A -0.9000
418 K A -1.5011
419 K A -1.2485
420 I A 0.0000
421 G A 0.0000
422 R A -1.1619
423 C A -0.6367
424 I A 0.0000
425 S A 0.0000
426 T A 0.0000
427 K A -0.9128
428 A A -0.7336
429 V A -0.6853
430 G A -1.2296
431 S A -1.1900
432 D A -2.0743
433 S A -1.4612
434 R A -1.2998
435 V A -0.5193
436 D A -1.3510
437 I A 0.0000
438 T A -1.1153
439 D A -1.8397
440 L A -0.4547
441 Y A 0.0000
442 K A 0.0000
443 Y A -1.4807
444 P A -1.5154
445 E A -1.8948
446 G A -1.4631
447 S A -1.9769
448 R A -3.1338
449 K A -3.0024
450 E A 0.0000
451 R A -2.3067
452 Q A -2.5672
453 V A 0.0000
454 Y A -1.1507
455 S A -1.3493
456 K A -1.5905
457 A A 0.0000
458 V A -0.7785
459 N A -1.3404
460 R A -1.3217
461 L A -0.4408
462 F A 0.1828
463 G A -0.4481
464 V A 0.2357
465 E A -1.8520
466 A A -0.9916
467 S A -1.6417
468 G A -1.8318
469 R A -2.4678
470 R A -2.3972
471 I A 0.4886
472 W A 0.5683
473 I A -0.4662
474 R A -2.5809
475 R A -2.6556
476 A A -1.6992
477 G A -1.8676
478 G A -2.1566
479 R A -2.4783
480 C A -1.0020
481 L A 0.4012
482 W A -0.2987
483 R A -2.6123
484 D A -2.9634
485 D A -2.9381
486 L A -0.8976
487 L A -1.0576
488 E A -2.2416
489 P A -1.2140
490 A A -0.8519
491 T A -1.3560
492 K A -2.3790
493 P A 0.0000
494 S A 0.0000
495 I A 0.0000
496 A A -0.2306
497 G A -1.4733
498 K A -2.2657
499 F A 0.0000
500 K A -0.9403
501 V A -0.3771
502 L A -1.0361
503 E A -2.2926
504 P A -1.6428
505 P A -1.3709
506 M A -0.9661
507 L A 0.0000
508 G A -0.7787
509 H A -2.0123
510 D A -2.9879
511 L A 0.0000
512 R A -2.4805
513 L A 0.0000
514 A A 0.0000
515 L A 0.0000
516 C A -2.0656
517 L A 0.0000
518 A A -1.6376
519 N A 0.0000
520 L A 0.2560
521 T A -0.6304
522 S A -1.0637
523 R A -1.9751
524 A A -1.9368
525 Q A -2.2548
526 R A -2.9849
527 E A 0.0000 mutated: VA527E
528 R A -2.2747
529 V A 0.0000
530 N A 0.0000
531 L A 0.0000
532 S A 0.0000
533 G A 0.0000
534 A A 0.0000
535 T A 0.0000
536 I A 0.0000
537 L A 0.0000
538 Y A 0.0000
539 T A 0.0000
540 R A 0.0000
541 K A -1.3823
542 P A -0.8338
543 V A -0.3646
544 A A -0.9327
545 E A -2.0582
546 I A 0.0000
547 L A 0.0000
548 H A -2.0419
549 E A -2.1449
550 S A -1.5039
551 H A -1.3789
552 A A -1.6295
553 V A 0.0000
554 R A -3.0224
555 L A 0.0000
556 G A -2.0259
557 P A -1.4590
558 Q A -1.8530
559 E A -2.5186
560 E A -3.1269
561 K A -3.0174
562 R A -2.8609
563 I A 0.0000
564 P A -1.0728
565 I A 0.0000
566 T A -1.2359
567 I A 0.0000
568 S A -1.8903
569 Y A 0.0000
570 S A -1.8351
571 K A -2.6888
572 Y A 0.0000
573 K A -2.2131
574 E A -2.7857
575 D A -1.9884
576 L A -0.9738
577 T A -0.7443
578 E A 0.0000
579 D A 0.0000
580 K A 0.0000
581 K A 0.0000
582 I A 0.0000
583 L A 0.0000
584 L A 0.0000
585 A A 0.0000
586 A A 0.0000
587 M A 0.0000
588 C A 0.0000
589 L A -1.1278
590 V A 0.0000
591 T A -1.8594
592 K A -2.3505
593 G A -1.9716
594 E A -2.3990
595 K A -1.6815
596 L A -0.2284
597 L A -0.2616
598 V A 0.0000
599 E A -1.2780
600 K A -1.2505
601 D A -0.8945
602 I A 0.0000
603 T A -0.6012
604 L A 0.0000
605 E A -0.8436
606 D A -0.0906
607 F A 1.0139
608 I A 0.9137
609 T A 0.3405
610 I A 0.0000
611 K A -0.3303
612 V A 0.4581
613 L A 0.9263
614 G A 0.4063
615 P A 0.0509
616 A A 0.0000
617 M A 0.1847
618 V A 0.0833
619 G A -0.0454
620 V A 0.7466
621 A A -0.0044
622 V A 0.0000
623 T A -0.6561
624 V A 0.0000
625 E A -0.8497
626 V A 0.0000
627 T A -0.5113
628 V A 0.0000
629 V A -1.1089
630 N A 0.0000
631 P A -0.7845
632 L A 0.0000
633 I A 0.9120
634 E A -1.0177
635 R A -2.9543
636 V A 0.0000
637 K A -3.1893
638 D A -2.9234
639 C A 0.0000
640 A A -1.1738
641 L A 0.0000
642 M A -0.0960
643 V A 0.0000
644 E A 0.0000
645 G A 0.0000
646 S A -0.9598
647 G A -1.2279
648 L A 0.0000
649 L A -1.1480
650 Q A -2.3214
651 E A -2.7353
652 Q A -1.2967
653 L A -0.3537
654 S A -0.5262
655 I A -0.6777
656 D A -2.0071
657 V A 0.0000
658 P A -1.5272
659 T A -2.1755
660 L A 0.0000
661 E A -3.1760
662 P A -2.0585
663 Q A -2.5343
664 E A -3.6330
665 R A -2.9508
666 A A -1.5336
667 S A -0.8562
668 V A -0.8609
669 Q A -1.3981
670 F A -1.1447
671 D A -1.6401
672 I A 0.0000
673 T A -0.5474
674 P A 0.0000
675 S A -1.0396
676 K A -1.9538
677 S A -1.2316
678 G A -0.9933
679 P A -0.8300
680 R A -0.5409
681 Q A 0.0000
682 L A 0.0000
683 Q A 0.0000
684 V A 0.0000
685 D A 0.0000
686 L A 0.0000
687 V A -0.3485
688 S A 0.0000
689 P A -1.2701
690 H A -1.4069
691 F A 0.0000
692 P A -0.1361
693 D A 0.0000
694 I A 0.0000
695 K A 0.2673
696 G A 0.7869
697 F A 1.6423
698 V A 1.3923
699 I A 1.5729
700 V A 0.0000
701 H A -0.8422
702 V A 0.0000
703 A A -0.3840
704 T A -0.2042
2 A B -0.5729
3 G B -1.7492
4 I B 0.0000
5 R B -2.7022
6 V B -1.9036
7 T B -1.4579
8 K B -1.8616
9 V B -1.1457
10 D B -1.7889
11 W B -1.3982
12 Q B -1.8998
13 R B -2.8330
14 S B -2.1772
15 R B -2.6249
16 N B 0.0000
17 G B 0.0000
18 A B -1.3975
19 A B -0.9231
20 H B 0.0000
21 H B -0.6157
22 T B 0.0000
23 Q B -1.9481
24 E B -1.0141
25 Y B 0.0000
26 P B -1.0420
27 C B -0.9920
28 P B -0.9235
29 E B -1.2789
30 L B 0.0000
31 V B 0.0000
32 V B 0.0000
33 R B 0.0000
34 R B 0.0000
35 G B -0.8032
36 Q B -0.3847
37 S B -0.2855
38 F B 0.0000
39 S B -1.0344
40 L B 0.0000
41 T B -0.9031
42 L B 0.0000
43 E B -2.2150
44 L B 0.0000
45 S B -1.6284
46 R B -1.7888
47 A B -1.4049
48 L B -1.0744
49 D B -1.1431
50 C B -0.4279
51 E B -1.9398
52 E B -1.3609
53 I B -0.0495
54 L B 0.0000
55 I B -0.4470
56 F B 0.0000
57 T B 0.0000
58 M B 0.0000
59 E B -1.6780
60 T B 0.0000
61 G B -1.4447
62 P B -1.4098
63 R B -2.3222
64 A B -1.8353
65 S B -1.7703
66 E B -2.2371
67 A B -0.9470
68 L B -0.7702
69 H B -1.5941
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695 K B 0.2707
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697 F B 2.2457
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700 V B 0.0000
701 H B -0.8616
702 V B 0.0000
703 A B -0.0794
704 T B -0.0004

 

Laboratory of Theory of Biopolymers 2015