Project name: SGLT 2 human mini itasser

Status: done

submitted: 2019-03-28 18:54:20, status changed: 2019-03-28 19:11:25
Settings
Chain sequence(s) A: MEEHTEAGSAPEMGAQKALIDNPADILVIAAYFLLVIGVGLWSMCRTNRGTVGGYFLAGRSMVWWPVGASLFASNIGSGHFVGLAGTGAASGLAVAGFEWNALFVVLLLGWLFAPVYLTAGVITMPQYLRKRFGGRRIRLYLSVLSLFLYIFTKISVDMFSGAVFIQQALGWNIYASVIALLGITMIYTVTGGLAALMYTDTVQTFVILGGACILMGYAFHEVGGYSGLFDKYLGAATSLTVSEDPAVGNISSFCYRPRPDSYHLLRHPVTGDLPWPALLLGLTIVSGWYWCSDQVIVQRCLAGKSLTHIKAGCILCGYLKLTPMFLMVMPGMISRILYPDEVACVVPEVCRRVCGTEVGCSNIAYPRLVVKLMPNGLRGLMLAVMLAALMSSLASIFNSSSTLFTMDIYTRLRPRAGDRELLLVGRLWVVFIVVVSVAWLPVVQAAQGGQLFDYIQAVSSYLAPPVSAVFVLALFVPRVNEQGAFWGLIGGLLMGLARLIPEFSFGSGSCVQPSACPAFLCGVHYLYFAIVLFFCSGLLTLTVSLCTAPIPRKHLHRLVFSLRHSKEEREDLDADEQQGSSLPVQNGCPESAMEMNEPQAPAPSLFRQCLLWFCGMSRGGVGSPPPLTQEEAAAAARRLEDISEDPSWARVVNLNALLMMAVAVFLWGFYA
Distance of aggregation 10 Å
Dynamic mode No
Show buried residues

Minimal score value
-3.5162
Maximal score value
3.1596
Average score
0.0162
Total score value
10.9132

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
1 M A -1.0853
2 E A -2.9119
3 E A -3.4640
4 H A -2.6445
5 T A -2.1839
6 E A -2.5550
7 A A -1.2999
8 G A -1.7987
9 S A -2.0626
10 A A -1.8118
11 P A -1.8031
12 E A -1.8940
13 M A -0.7203
14 G A -1.3099
15 A A -0.9391
16 Q A -1.2292
17 K A -1.0026
18 A A -0.1471
19 L A 1.0272
20 I A 1.0688
21 D A 0.2260
22 N A 0.1178
23 P A 0.5470
24 A A 0.4387
25 D A 0.0000
26 I A 1.5717
27 L A 2.3396
28 V A 1.7615
29 I A 0.0000
30 A A 2.0255
31 A A 2.0876
32 Y A 0.0000
33 F A 2.5301
34 L A 3.0387
35 L A 3.1115
36 V A 2.4712
37 I A 3.0595
38 G A 2.5582
39 V A 2.3705
40 G A 0.0000
41 L A 2.5540
42 W A 2.0083
43 S A 1.0211
44 M A 0.0000
45 C A -0.0121
46 R A -1.6745
47 T A -1.2741
48 N A -0.9853
49 R A -2.0066
50 G A -1.1801
51 T A -0.3455
52 V A 1.4113
53 G A 0.3286
54 G A -0.3718
55 Y A 0.6898
56 F A 1.2566
57 L A 0.5987
58 A A -0.4625
59 G A -0.9764
60 R A -2.0910
61 S A -1.0457
62 M A -0.4166
63 V A 0.0000
64 W A 0.5740
65 W A 0.9821
66 P A 0.0000
67 V A 0.0000
68 G A 0.0000
69 A A 0.0000
70 S A -0.0670
71 L A 0.0000
72 F A 0.0000
73 A A -0.2252
74 S A -0.2720
75 N A 0.0000
76 I A 0.0000
77 G A -0.3122
78 S A 0.0000
79 G A -0.2925
80 H A -0.3365
81 F A 0.0000
82 V A 0.0000
83 G A 0.0000
84 L A 0.0000
85 A A 0.0000
86 G A 0.0000
87 T A 0.0000
88 G A 0.0000
89 A A 0.0000
90 A A 0.2266
91 S A 0.0000
92 G A 0.0000
93 L A 0.0000
94 A A 0.0000
95 V A 0.0029
96 A A 0.0000
97 G A 0.0000
98 F A 0.0000
99 E A 0.0000
100 W A 0.0000
101 N A 0.5375
102 A A 0.0000
103 L A 0.0000
104 F A 0.8787
105 V A 0.0000
106 V A 0.0000
107 L A 0.0000
108 L A 0.6200
109 L A 0.0000
110 G A 0.0000
111 W A -0.2846
112 L A -0.0853
113 F A 0.0000
114 A A 0.0000
115 P A 0.0000
116 V A 0.0000
117 Y A 0.0000
118 L A 0.2902
119 T A -0.5801
120 A A -0.3113
121 G A -0.1467
122 V A 0.0000
123 I A 1.4278
124 T A 0.4437
125 M A -0.1736
126 P A -0.6708
127 Q A -0.9052
128 Y A 0.0000
129 L A 0.0000
130 R A -2.1689
131 K A -1.6964
132 R A 0.0000
133 F A 0.0000
134 G A -1.5203
135 G A -1.8182
136 R A -2.0847
137 R A -1.4435
138 I A 0.0000
139 R A -0.7514
140 L A 0.0609
141 Y A 0.7536
142 L A 0.0000
143 S A 0.0000
144 V A 1.5053
145 L A 0.9597
146 S A 0.6174
147 L A 0.0000
148 F A 0.9823
149 L A 0.0000
150 Y A 0.0000
151 I A 1.1275
152 F A 0.9011
153 T A 0.0000
154 K A -0.2749
155 I A 0.0000
156 S A 0.0000
157 V A 0.0000
158 D A -0.3471
159 M A 0.0000
160 F A 0.0000
161 S A 0.0000
162 G A 0.0000
163 A A 0.0000
164 V A 0.0000
165 F A 0.0000
166 I A 0.0000
167 Q A -0.0949
168 Q A -0.1582
169 A A 0.1486
170 L A 0.1784
171 G A -0.0404
172 W A 0.1593
173 N A -0.4007
174 I A 0.4780
175 Y A 1.4687
176 A A 0.7476
177 S A 0.0000
178 V A 0.0000
179 I A 1.4321
180 A A 0.7274
181 L A 0.0000
182 L A 0.0000
183 G A 1.0359
184 I A 1.4388
185 T A 0.0000
186 M A 1.8542
187 I A 2.5451
188 Y A 1.4687
189 T A 0.0000
190 V A 1.7216
191 T A 0.8621
192 G A 0.7308
193 G A -0.0540
194 L A -0.1638
195 A A -0.1850
196 A A 0.5335
197 L A 0.0000
198 M A 0.9295
199 Y A 1.3777
200 T A 0.8307
201 D A -0.3229
202 T A 0.6313
203 V A 0.8560
204 Q A 0.1075
205 T A 0.0000
206 F A 0.7465
207 V A 0.0000
208 I A 0.0000
209 L A 0.0000
210 G A 0.6021
211 G A 0.0000
212 A A 0.0000
213 C A 0.7637
214 I A 1.2046
215 L A 0.0000
216 M A 0.6556
217 G A 0.7352
218 Y A 0.5124
219 A A 0.0000
220 F A 0.0000
221 H A -0.1032
222 E A -0.4536
223 V A 0.1693
224 G A 0.0864
225 G A 0.0988
226 Y A 0.8756
227 S A 0.3763
228 G A 0.6648
229 L A 1.5488
230 F A 1.7444
231 D A -0.1810
232 K A 0.0000
233 Y A 0.8174
234 L A 0.5714
235 G A 0.0833
236 A A 0.0000
237 A A 0.0000
238 T A 0.0312
239 S A -0.1743
240 L A -0.0266
241 T A -0.2248
242 V A 0.0664
243 S A 0.0000
244 E A 0.0000
245 D A -1.3423
246 P A -0.4524
247 A A -0.2364
248 V A 0.0000
249 G A 0.0652
250 N A -0.1986
251 I A 1.3875
252 S A 0.7497
253 S A 0.2057
254 F A 0.5456
255 C A 0.0000
256 Y A 0.0050
257 R A -0.8828
258 P A -1.6201
259 R A -2.6795
260 P A -1.9620
261 D A -2.2726
262 S A -1.3815
263 Y A -0.1137
264 H A 0.0000
265 L A 0.7172
266 L A 1.0052
267 R A -0.1513
268 H A 0.0000
269 P A 0.0000
270 V A -0.1223
271 T A 0.0000
272 G A 0.0000
273 D A -0.0839
274 L A 0.0000
275 P A 0.0000
276 W A 1.0984
277 P A 1.1217
278 A A 0.0000
279 L A 1.4225
280 L A 2.1567
281 L A 1.6856
282 G A 0.0000
283 L A 0.0000
284 T A 0.6705
285 I A 0.0000
286 V A 0.0000
287 S A 0.0000
288 G A 0.0260
289 W A 0.0581
290 Y A -0.0219
291 W A 0.0000
292 C A 0.0000
293 S A 0.0000
294 D A -0.5975
295 Q A 0.0000
296 V A 0.5853
297 I A 0.8168
298 V A 0.0000
299 Q A 0.0000
300 R A 0.6978
301 C A 0.0000
302 L A 0.0000
303 A A -0.0490
304 G A 0.0000
305 K A -1.3694
306 S A -0.5189
307 L A 0.0419
308 T A -0.5030
309 H A -0.3471
310 I A 0.0000
311 K A 0.0000
312 A A -0.1765
313 G A 0.0000
314 C A 0.0000
315 I A 0.0000
316 L A 0.0000
317 C A 0.0000
318 G A 0.0000
319 Y A 0.2065
320 L A 0.0000
321 K A 0.0000
322 L A 0.0000
323 T A 0.0000
324 P A 0.0000
325 M A 0.0000
326 F A 0.3036
327 L A 0.0000
328 M A 0.0000
329 V A 0.0000
330 M A 0.0000
331 P A 0.0000
332 G A 0.0000
333 M A 0.0000
334 I A 0.0000
335 S A 0.0000
336 R A -0.2335
337 I A 0.0000
338 L A 0.0000
339 Y A -0.2747
340 P A -0.6187
341 D A -0.3001
342 E A -0.3944
343 V A 1.7678
344 A A 1.1675
345 C A 1.3584
346 V A 2.6473
347 V A 2.5001
348 P A 1.2335
349 E A 0.9430
350 V A 1.6468
351 C A 0.7825
352 R A 0.4067
353 R A -0.3325
354 V A 1.1670
355 C A 0.4589
356 G A 0.2174
357 T A -0.0139
358 E A -0.4475
359 V A 0.5837
360 G A -0.2956
361 C A -0.3909
362 S A 0.0000
363 N A 0.0000
364 I A 0.0000
365 A A -0.0060
366 Y A 0.0000
367 P A 0.0000
368 R A 0.0000
369 L A 0.0000
370 V A 0.0000
371 V A 0.0000
372 K A -0.0024
373 L A -0.0194
374 M A 0.0000
375 P A -0.5837
376 N A -1.2262
377 G A -0.1155
378 L A 0.3794
379 R A -0.1238
380 G A 0.0000
381 L A 0.9101
382 M A 0.0000
383 L A 0.0000
384 A A 0.0000
385 V A 0.0000
386 M A 0.0000
387 L A 0.0000
388 A A 0.0000
389 A A 0.0000
390 L A 0.0000
391 M A 0.4340
392 S A -0.1064
393 S A -0.2485
394 L A 0.0000
395 A A 0.0000
396 S A -0.2294
397 I A -0.1924
398 F A 0.0000
399 N A -0.4151
400 S A -0.2488
401 S A 0.0000
402 S A 0.0000
403 T A 0.4432
404 L A 0.6462
405 F A 0.7682
406 T A 0.0000
407 M A 0.8845
408 D A 0.0000
409 I A 0.8452
410 Y A 0.5615
411 T A -0.4820
412 R A -0.2540
413 L A 0.6465
414 R A -1.1240
415 P A -1.3807
416 R A -2.4803
417 A A -2.1832
418 G A -2.3750
419 D A -2.7859
420 R A -2.3906
421 E A -1.2950
422 L A 0.0000
423 L A 0.0544
424 L A 1.3798
425 V A 1.1787
426 G A 0.8416
427 R A 1.3078
428 L A 2.4117
429 W A 1.7430
430 V A 0.0000
431 V A 2.0957
432 F A 2.3605
433 I A 0.0000
434 V A 0.0000
435 V A 2.8235
436 V A 2.1240
437 S A 0.0000
438 V A 1.8234
439 A A 1.4831
440 W A 1.2999
441 L A 0.0000
442 P A 0.9284
443 V A 0.6538
444 V A 0.0000
445 Q A -0.4564
446 A A -0.2737
447 A A -0.5062
448 Q A -1.2642
449 G A -0.7941
450 G A -0.5014
451 Q A -0.1732
452 L A 0.0000
453 F A 0.0000
454 D A -0.1019
455 Y A 0.1759
456 I A 0.4492
457 Q A 0.2237
458 A A 0.3946
459 V A 0.5392
460 S A 0.0000
461 S A 0.0000
462 Y A 0.8272
463 L A 0.0000
464 A A 0.0000
465 P A 0.0000
466 P A 0.0000
467 V A 0.4387
468 S A 0.0000
469 A A 0.0000
470 V A 0.0000
471 F A 0.0000
472 V A 0.8751
473 L A 0.0000
474 A A 0.0000
475 L A 0.0000
476 F A 1.3253
477 V A 0.4121
478 P A 0.0000
479 R A -1.0141
480 V A 0.0000
481 N A -0.6287
482 E A -0.7343
483 Q A -0.5409
484 G A 0.0000
485 A A 0.0000
486 F A 0.6310
487 W A 1.1945
488 G A 0.0000
489 L A 0.0000
490 I A 1.5790
491 G A 1.2579
492 G A 0.0000
493 L A 1.4735
494 L A 2.0977
495 M A 1.3780
496 G A 0.0000
497 L A 2.0633
498 A A 1.3852
499 R A 0.9235
500 L A 1.4258
501 I A 1.9102
502 P A 0.3037
503 E A -1.0394
504 F A 0.1142
505 S A -0.0805
506 F A 0.0000
507 G A 0.1303
508 S A -0.0784
509 G A 0.2307
510 S A 0.0143
511 C A 0.2684
512 V A 0.4640
513 Q A -0.1734
514 P A -0.2621
515 S A -0.3108
516 A A 0.0228
517 C A 0.2734
518 P A 0.0722
519 A A 0.0931
520 F A 0.3893
521 L A 0.0000
522 C A 0.1037
523 G A 0.0000
524 V A 0.0000
525 H A 0.0000
526 Y A 0.5588
527 L A 0.0000
528 Y A 0.5273
529 F A 0.0000
530 A A 0.0000
531 I A 0.0000
532 V A 0.8551
533 L A 0.0000
534 F A 1.2127
535 F A 1.8584
536 C A 1.5187
537 S A 0.0000
538 G A 0.0000
539 L A 2.1633
540 L A 1.6474
541 T A 0.0000
542 L A 1.0220
543 T A 0.9740
544 V A 0.0000
545 S A 0.0000
546 L A 0.6347
547 C A 0.9571
548 T A 0.3014
549 A A -0.1296
550 P A 0.1559
551 I A 0.0233
552 P A -1.1905
553 R A -2.4384
554 K A -1.8824
555 H A -1.1607
556 L A 0.0000
557 H A -1.2988
558 R A -1.4328
559 L A 0.0000
560 V A 0.0000
561 F A 0.0000
562 S A 0.0000
563 L A 0.0000
564 R A 0.0000
565 H A 0.0000
566 S A 0.0000
567 K A -0.8795
568 E A 0.0000
569 E A -2.5710
570 R A -3.5009
571 E A -2.7728
572 D A 0.0000
573 L A 0.0000
574 D A -1.4232
575 A A -0.9272
576 D A -0.7326
577 E A 0.0000
578 Q A 0.0000
579 Q A 0.0000
580 G A -0.5801
581 S A -0.5080
582 S A 0.0000
583 L A -0.7895
584 P A -1.1934
585 V A -0.8280
586 Q A -1.3548
587 N A -2.1374
588 G A -1.6436
589 C A 0.0000
590 P A 0.0000
591 E A -2.5175
592 S A -1.6808
593 A A -1.1616
594 M A -0.6422
595 E A -1.8267
596 M A 0.0000
597 N A -1.4316
598 E A -2.4291
599 P A -1.5281
600 Q A -1.4540
601 A A -1.1152
602 P A -0.6521
603 A A 0.0000
604 P A -1.0091
605 S A -0.9721
606 L A 0.0000
607 F A 0.0000
608 R A -1.3111
609 Q A -0.6313
610 C A 0.0000
611 L A 1.0487
612 L A 1.3641
613 W A 0.0000
614 F A 0.0000
615 C A 0.8748
616 G A 0.1050
617 M A 0.0000
618 S A -0.8623
619 R A -1.3261
620 G A -0.6392
621 G A 0.0000
622 V A -0.0713
623 G A 0.2261
624 S A -0.1476
625 P A 0.0000
626 P A -0.3469
627 P A -0.4865
628 L A 0.5630
629 T A -0.1500
630 Q A 0.0000
631 E A -2.0918
632 E A -1.7119
633 A A -1.1952
634 A A -1.6996
635 A A -1.8537
636 A A 0.0000
637 A A -1.5319
638 R A -2.8186
639 R A -2.1144
640 L A 0.0000
641 E A -1.9534
642 D A -3.0592
643 I A -2.3001
644 S A -1.3376
645 E A -3.5162
646 D A -3.3290
647 P A -2.2654
648 S A 0.0000
649 W A 0.0000
650 A A 0.0000
651 R A -2.3038
652 V A -0.4393
653 V A 0.0000
654 N A -0.2372
655 L A 0.7200
656 N A 0.0000
657 A A 0.0000
658 L A -0.4995
659 L A -0.4247
660 M A 0.0000
661 M A 0.0000
662 A A 0.0000
663 V A 2.2270
664 A A 0.0000
665 V A 2.5989
666 F A 2.3279
667 L A 0.0000
668 W A 1.6592
669 G A 1.6110
670 F A 3.1596
671 Y A 2.6096
672 A A 1.8313

 

Laboratory of Theory of Biopolymers 2015