Project name: Full TAU and Pin1

Status: done

submitted: 2019-02-24 21:40:26, status changed: 2019-02-24 22:02:29
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Chain sequence(s) A: MAEPRQEFEVMEDHAGTYGLGDRKDQGGYTMHQDQEGDTDAGLKESPLQTPTEDGSEEPGSETSDAKSTPTAEDVTAPLVDEGAPGKQAAAQPHTEIPEGTTAEEAGIGDTPSLEDEAAGHVTQARMVSKSKDGTGSDDKKAKGADGKTKIATPRGAAPPGQKGQANATRIPAKTPPAPKTPPSSGEPPKSGDRSGYSSPGSPGTPGSRSRTPSLPTPPTREPKKVAVVRTPPKSPSSAKSRLQTAPVPMPDLKNVKSKIGSTENLKHQPGGGKVQIINKKLDLSNVQSKCGSKDNIKHVPGGGSVQIVYKPVDLSKVTSKCGSLGNIHHKPGGGQVEVKSEKLDFKDRVQSKIGSLDNITHVPGGGNKKIETHKLTFRENAKAKTDHGAEIVYKSPVVSGDTSPRHLSNVSSTGSIDMVDSPQLATLADEVSASLAKQGL
B: MADEEKLPPGWEKRMSRSSGRVYYFNHITNASQWERPSGNSSSGGKNGQGEPARVRCSHLLVKHSQSRRPSSWRQEKITRTKEEALELINGYIQKIKSGEEDFESLASQFSDCSSAKARGDLGAFSRGQMQKPFEDASFALRTGEMSGPVFTDSGIHIILRTE
Distance of aggregation 10 Å
Dynamic mode No
Show buried residues

Minimal score value
-3.837
Maximal score value
1.8638
Average score
-1.263
Total score value
-762.8739

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 -0.0445
2 A A -1.3000
3 E A -2.3675
4 P A -2.2611
5 R A -3.0027
6 Q A -2.4298
7 E A -1.6169
8 F A 0.0000
9 E A -1.9741
10 V A 0.0000
11 M A -1.4382
12 E A -2.5429
13 D A -2.7376
14 H A 0.0000
15 A A -1.8238
16 G A -1.7594
17 T A -1.4623
18 Y A -1.8313
19 G A -1.8576
20 L A -1.3169
21 G A -1.9778
22 D A -3.1094
23 R A -3.0355
24 K A -2.7970
25 D A -2.2287
26 Q A 0.0000
27 G A 0.0000
28 G A -0.0844
29 Y A 0.8259
30 T A 0.7324
31 M A 0.5700
32 H A -0.9713
33 Q A -2.5026
34 D A -3.6090
35 Q A 0.0000
36 E A -2.7904
37 G A -2.9668
38 D A -3.2701
39 T A -2.4601
40 D A -2.5993
41 A A -1.8449
42 G A -1.1216
43 L A -0.3353
44 K A -2.3488
45 E A -2.8360
46 S A -1.3086
47 P A -0.1222
48 L A 0.5838
49 Q A -0.2660
50 T A 0.0000
51 P A 0.0000
52 T A -2.9812
53 E A -3.5517
54 D A -2.3441
55 G A -1.8537
56 S A -1.5752
57 E A -2.7836
58 E A -2.4224
59 P A -1.8168
60 G A -1.6903
61 S A -1.9826
62 E A -2.4861
63 T A -2.2058
64 S A -1.8848
65 D A -2.1664
66 A A -1.5578
67 K A -2.4282
68 S A -1.2049
69 T A -1.0147
70 P A -1.3421
71 T A 0.0000
72 A A 0.0000
73 E A -2.0181
74 D A -1.3699
75 V A -0.1144
76 T A -0.3138
77 A A 0.4610
78 P A 0.6867
79 L A 1.3700
80 V A 0.4341
81 D A -1.8458
82 E A -2.4137
83 G A -1.8500
84 A A -1.4605
85 P A -1.4287
86 G A -1.8105
87 K A -2.7855
88 Q A -2.1562
89 A A -1.4647
90 A A -1.3325
91 A A -1.2781
92 Q A -1.6279
93 P A -1.9275
94 H A -2.3479
95 T A -2.1284
96 E A -2.7971
97 I A -1.4720
98 P A -1.9722
99 E A -2.7368
100 G A -2.0976
101 T A -1.8881
102 T A -1.7204
103 A A -2.2201
104 E A -2.9127
105 E A -2.6391
106 A A -2.0862
107 G A -1.9190
108 I A -0.9362
109 G A -1.9772
110 D A -2.5840
111 T A -1.8376
112 P A -1.3023
113 S A -1.3381
114 L A -1.6101
115 E A -2.7822
116 D A -2.7271
117 E A -1.9248
118 A A 0.0000
119 A A -0.5299
120 G A -1.1057
121 H A -1.0688
122 V A 0.8429
123 T A 0.0000
124 Q A -0.6791
125 A A -0.9301
126 R A 0.0000
127 M A -0.0599
128 V A -0.0342
129 S A -1.1265
130 K A -2.1531
131 S A -2.0972
132 K A -2.8967
133 D A -3.6760
134 G A -2.1012
135 T A -1.5372
136 G A -1.8021
137 S A -2.6910
138 D A -3.2670
139 D A -3.7639
140 K A -3.2087
141 K A -2.1263
142 A A 0.0000
143 K A -1.2871
144 G A -1.5823
145 A A -1.8611
146 D A -3.1096
147 G A -2.6333
148 K A -2.6618
149 T A -2.0607
150 K A -1.6513
151 I A 0.4525
152 A A 0.0017
153 T A -0.3481
154 P A -1.2973
155 R A -2.5912
156 G A -1.9435
157 A A -1.1730
158 A A -1.1002
159 P A -1.0358
160 P A -1.5012
161 G A -2.3185
162 Q A -2.9659
163 K A -3.3905
164 G A -2.7398
165 Q A -2.8561
166 A A -2.3086
167 N A -2.6013
168 A A -1.2297
169 T A -1.1033
170 R A -1.4524
171 I A 0.3847
172 P A -0.0972
173 A A -0.9193
174 K A -1.9613
175 T A -1.0441
176 P A -1.0774
177 P A -0.9132
178 A A -0.7376
179 P A -1.4554
180 K A -1.9548
181 T A -1.1286
182 P A -1.1663
183 P A -1.4084
184 S A 0.0000
185 S A -0.5946
186 G A -1.2015
187 E A -1.8850
188 P A -2.1346
189 P A -1.9175
190 K A -2.8465
191 S A -2.4657
192 G A -2.0891
193 D A -3.3690
194 R A -3.4527
195 S A 0.0000
196 G A -1.3014
197 Y A 0.0000
198 S A -0.6586
199 S A 0.0000
200 P A -0.7265
201 G A -0.9379
202 S A -0.4789
203 P A -0.5258
204 G A -1.1616
205 T A -0.9154
206 P A -0.9766
207 G A -0.5700
208 S A 0.0000
209 R A -1.0287
210 S A -1.0751
211 R A -2.0329
212 T A -1.2489
213 P A -1.2354
214 S A -1.1855
215 L A -1.3347
216 P A 0.0000
217 T A -2.2421
218 P A -2.2101
219 P A -1.2124
220 T A -1.4641
221 R A -3.2557
222 E A -3.2497
223 P A 0.0000
224 K A -3.3972
225 K A -2.4184
226 V A -0.6660
227 A A 0.3388
228 V A 1.8638
229 V A 1.7538
230 R A -0.9681
231 T A -1.2926
232 P A -1.2720
233 P A -1.5512
234 K A -2.1084
235 S A 0.0000
236 P A 0.0000
237 S A -0.7524
238 S A 0.0000
239 A A -0.9805
240 K A -1.3110
241 S A -1.8434
242 R A -2.3544
243 L A -0.8466
244 Q A -1.2040
245 T A -0.5673
246 A A -0.1518
247 P A -0.2702
248 V A -0.0747
249 P A 0.0000
250 M A -0.7640
251 P A -1.0792
252 D A -1.6934
253 L A -0.2162
254 K A -1.4269
255 N A -1.6383
256 V A -0.8507
257 K A -2.0088
258 S A -1.6442
259 K A -1.2749
260 I A 0.2991
261 G A -1.1869
262 S A -1.2093
263 T A -1.0556
264 E A -2.0879
265 N A -2.2778
266 L A -1.0680
267 K A -2.3971
268 H A -2.2580
269 Q A -2.0608
270 P A -1.6951
271 G A -1.9079
272 G A -1.0415
273 G A -0.3929
274 K A -0.4680
275 V A -0.1274
276 Q A -1.7308
277 I A -1.1166
278 I A 0.0000
279 N A -2.6906
280 K A -2.9755
281 K A -2.2457
282 L A -0.9869
283 D A 0.0000
284 L A -1.5150
285 S A -1.4586
286 N A -1.9240
287 V A -1.1007
288 Q A -1.9387
289 S A -1.8005
290 K A -2.1423
291 C A -2.1622
292 G A -2.2999
293 S A -2.3077
294 K A -3.3177
295 D A -3.3779
296 N A -2.1541
297 I A -1.4180
298 K A -2.1001
299 H A 0.0000
300 V A 0.0000
301 P A 0.1161
302 G A -0.7893
303 G A -0.8596
304 G A -0.3050
305 S A 0.1604
306 V A 1.5386
307 Q A 0.2883
308 I A 0.0000
309 V A 0.9334
310 Y A 0.8070
311 K A -0.8428
312 P A 0.0972
313 V A 1.1601
314 D A -0.6774
315 L A 0.3705
316 S A -0.5556
317 K A -1.6968
318 V A -0.3190
319 T A -0.2843
320 S A -0.8613
321 K A -1.6055
322 C A -0.8464
323 G A -0.3075
324 S A 0.0000
325 L A 0.0270
326 G A -0.4472
327 N A -0.4020
328 I A 0.7959
329 H A -0.7749
330 H A -1.2292
331 K A -0.8647
332 P A -1.1578
333 G A -1.6208
334 G A -1.5397
335 G A -2.0608
336 Q A -3.1012
337 V A -2.2213
338 E A -2.1845
339 V A -0.5364
340 K A -2.0807
341 S A -1.9683
342 E A -2.6993
343 K A -1.5655
344 L A -0.2406
345 D A -0.9919
346 F A 0.4287
347 K A -0.8524
348 D A -1.6134
349 R A -1.6210
350 V A -0.0345
351 Q A -1.5490
352 S A -1.0244
353 K A -1.1314
354 I A 0.7675
355 G A 0.0335
356 S A 0.3362
357 L A 0.6661
358 D A -0.5380
359 N A -0.8306
360 I A -0.0440
361 T A -0.2787
362 H A -0.2631
363 V A 1.0994
364 P A -0.0254
365 G A -0.8438
366 G A -1.3050
367 G A -1.4850
368 N A -2.1937
369 K A -2.1584
370 K A -2.8064
371 I A -2.7944
372 E A -3.4567
373 T A -2.7719
374 H A -2.2627
375 K A -1.6758
376 L A 0.7098
377 T A 0.5307
378 F A 0.9380
379 R A -1.4945
380 E A -2.9797
381 N A -2.4856
382 A A -2.0098
383 K A -2.8114
384 A A -1.8257
385 K A -2.7461
386 T A -1.9847
387 D A -2.1975
388 H A -2.2060
389 G A -1.1112
390 A A -0.5541
391 E A -0.9308
392 I A 0.0435
393 V A 0.0593
394 Y A -0.9807
395 K A -1.6087
396 S A -0.1396
397 P A 0.5681
398 V A 1.2688
399 V A 1.6074
400 S A 0.0290
401 G A -0.3787
402 D A -1.0847
403 T A -0.9469
404 S A -0.8273
405 P A -1.1075
406 R A -2.3469
407 H A -1.3972
408 L A 0.0128
409 S A -0.6288
410 N A -1.3852
411 V A -0.9093
412 S A -0.8936
413 S A -0.6368
414 T A 0.0766
415 G A 0.0000
416 S A 0.6238
417 I A 1.6079
418 D A -0.3016
419 M A 0.7382
420 V A 0.1235
421 D A -1.0671
422 S A -0.5821
423 P A -0.2123
424 Q A -0.7524
425 L A 0.0000
426 A A 0.6879
427 T A 0.3834
428 L A 0.9282
429 A A -0.2408
430 D A -1.8343
431 E A -1.7062
432 V A 0.2912
433 S A -0.3225
434 A A -0.0103
435 S A -0.0781
436 L A -0.1608
437 A A -0.6276
438 K A -1.8045
439 Q A -0.9132
440 G A -0.4375
441 L A 1.2166
1 M B 0.4076
2 A B -0.6686
3 D B 0.0000
4 E B -2.1398
5 E B -2.6619
6 K B -2.2024
7 L B -1.4322
8 P B -0.7502
9 P B -0.3183
10 G B -0.3249
11 W B -1.3530
12 E B -2.5959
13 K B -2.1979
14 R B -1.8456
15 M B -0.6469
16 S B -1.2844
17 R B -2.2762
18 S B -1.3807
19 S B -1.3418
20 G B -1.3912
21 R B -1.7107
22 V B -0.2222
23 Y B -0.8001
24 Y B -1.2299
25 F B -1.3110
26 N B -1.0609
27 H B -0.8326
28 I B 1.0916
29 T B -0.0452
30 N B -1.1483
31 A B -0.8020
32 S B -1.4599
33 Q B -1.1475
34 W B -0.3736
35 E B -1.8597
36 R B -2.5792
37 P B -1.6048
38 S B -1.4453
39 G B -1.6673
40 N B 0.0000
41 S B -0.9902
42 S B -0.6508
43 S B -0.9055
44 G B -1.2714
45 G B -1.3929
46 K B -2.6557
47 N B -2.6257
48 G B -2.5857
49 Q B -2.6452
50 G B -2.1739
51 E B -2.7767
52 P B -2.3706
53 A B -2.0662
54 R B -3.2896
55 V B 0.0000
56 R B -1.7467
57 C B 0.0000
58 S B 0.0000
59 H B 0.0000
60 L B 0.0000
61 L B 0.0000
62 V B 0.0000
63 K B 0.0000
64 H B 0.0000
65 S B -2.0102
66 Q B -2.3821
67 S B 0.0000
68 R B -3.6235
69 R B -3.7663
70 P B -2.9443
71 S B -2.6578
72 S B -1.4135
73 W B -0.1414
74 R B -1.8103
75 Q B -2.8574
76 E B -3.5359
77 K B -3.4925
78 I B 0.0000
79 T B -1.6657
80 R B -2.0322
81 T B -2.4652
82 K B -3.4394
83 E B -3.8370
84 E B -3.4133
85 A B 0.0000
86 L B -2.2080
87 E B -3.1418
88 L B -1.2466
89 I B 0.0000
90 N B -2.0081
91 G B -1.5703
92 Y B 0.0000
93 I B -1.7791
94 Q B -2.7732
95 K B -3.3761
96 I B 0.0000
97 K B -3.2569
98 S B -2.7913
99 G B -2.9636
100 E B -3.5964
101 E B -3.4808
102 D B -3.5008
103 F B 0.0000
104 E B -2.9559
105 S B -2.1118
106 L B 0.0000
107 A B 0.0000
108 S B -2.0665
109 Q B -1.6181
110 F B -0.4329
111 S B 0.0000
112 D B 0.0000
113 C B -0.1863
114 S B -0.6185
115 S B 0.0000
116 A B -1.8340
117 K B -2.1528
118 A B -1.8494
119 R B -2.9387
120 G B 0.0000
121 D B -1.2226
122 L B -0.2162
123 G B -0.6216
124 A B -1.1717
125 F B 0.0000
126 S B -2.3886
127 R B -2.7551
128 G B -2.7415
129 Q B -2.1805
130 M B -1.4639
131 Q B -2.2075
132 K B -2.8405
133 P B -1.3969
134 F B 0.0000
135 E B 0.0000
136 D B -2.3081
137 A B -1.1040
138 S B 0.0000
139 F B -0.8632
140 A B -0.5956
141 L B -0.8946
142 R B -2.1547
143 T B -1.8394
144 G B -1.6356
145 E B -1.5355
146 M B -0.5948
147 S B 0.0000
148 G B -0.1605
149 P B 0.0201
150 V B 0.6344
151 F B 1.0058
152 T B -0.6448
153 D B -2.5233
154 S B -1.8590
155 G B 0.0000
156 I B 0.0000
157 H B 0.0000
158 I B 0.0000
159 I B 0.0000
160 L B -0.8194
161 R B -1.4471
162 T B -1.7337
163 E B -2.7929

 

Laboratory of Theory of Biopolymers 2015