Project name: Full TAU and Pin1

Status: done

submitted: 2019-02-19 03:25:53, status changed: 2019-02-19 03:47:10
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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
-4.0423
Maximal score value
1.8638
Average score
-1.2723
Total score value
-768.4921

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 -0.0435
2 A A -1.3020
3 E A -2.3675
4 P A -2.2665
5 R A -3.0077
6 Q A -2.4347
7 E A -1.6255
8 F A 0.0000
9 E A -1.9789
10 V A 0.0000
11 M A -1.4377
12 E A -2.5457
13 D A -2.7430
14 H A 0.0000
15 A A -1.8214
16 G A -1.7651
17 T A -1.4538
18 Y A -1.7843
19 G A 0.0000
20 L A -1.2836
21 G A -1.9621
22 D A -3.0935
23 R A -3.0183
24 K A -2.7849
25 D A -2.1742
26 Q A 0.0000
27 G A 0.0000
28 G A -0.0823
29 Y A 0.8317
30 T A 0.7359
31 M A 0.5679
32 H A -0.9747
33 Q A -2.5038
34 D A -3.6058
35 Q A 0.0000
36 E A -2.7770
37 G A -2.9498
38 D A -3.2449
39 T A -2.4511
40 D A -2.5943
41 A A -1.8389
42 G A -1.1186
43 L A -0.3339
44 K A -2.3478
45 E A -2.8362
46 S A -1.3079
47 P A -0.1229
48 L A 0.5886
49 Q A -0.2546
50 T A 0.0000
51 P A 0.0000
52 T A -2.9758
53 E A -3.5436
54 D A -2.3339
55 G A -1.8535
56 S A -1.5772
57 E A -2.7533
58 E A -2.3856
59 P A -1.7327
60 G A -1.4981
61 S A -1.8837
62 E A -2.4341
63 T A -2.1630
64 S A -1.8941
65 D A -2.1621
66 A A -1.5544
67 K A -2.4219
68 S A -1.2009
69 T A -1.0154
70 P A -1.3481
71 T A 0.0000
72 A A 0.0000
73 E A -2.0389
74 D A -1.3789
75 V A -0.1120
76 T A -0.3185
77 A A 0.4627
78 P A 0.6953
79 L A 1.3853
80 V A 0.4647
81 D A -1.8307
82 E A -2.4059
83 G A -1.8463
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 -1.4638
90 A A -1.3320
91 A A -1.2780
92 Q A -1.6286
93 P A -1.9295
94 H A -2.3430
95 T A -2.1239
96 E A -2.7934
97 I A -1.4673
98 P A -1.9707
99 E A -2.7341
100 G A -2.0915
101 T A -1.8934
102 T A -1.7416
103 A A -2.2112
104 E A -2.9071
105 E A -2.6379
106 A A -2.1468
107 G A -1.9776
108 I A -0.9592
109 G A -1.9686
110 D A -2.5808
111 T A -1.8385
112 P A -1.3046
113 S A -1.3959
114 L A -1.7285
115 E A -2.9729
116 D A -3.0763
117 E A -2.1767
118 A A 0.0000
119 A A -0.6263
120 G A -1.2032
121 H A -1.1604
122 V A 0.8352
123 T A -0.5043
124 Q A -0.6937
125 A A -0.9430
126 R A 0.0000
127 M A -0.1043
128 V A -0.0843
129 S A -1.1778
130 K A -2.1879
131 S A -2.1534
132 K A -2.9713
133 D A -3.7149
134 G A -2.1225
135 T A -1.5544
136 G A -1.8258
137 S A -2.7437
138 D A -3.3039
139 D A -3.8681
140 K A -3.4544
141 K A -2.3363
142 A A 0.0000
143 K A -1.4280
144 G A -1.6321
145 A A -1.8921
146 D A -3.1267
147 G A -2.6346
148 K A -2.6383
149 T A -2.0485
150 K A -1.5966
151 I A 0.6056
152 A A 0.0430
153 T A -0.3160
154 P A -1.2757
155 R A -2.5920
156 G A -1.9427
157 A A -1.1721
158 A A -1.0990
159 P A -1.0283
160 P A -1.4866
161 G A -2.2961
162 Q A -2.9232
163 K A -3.3706
164 G A -2.7277
165 Q A -2.8397
166 A A -2.2936
167 N A -2.5916
168 A A -1.2255
169 T A -1.1006
170 R A -1.4477
171 I A 0.3890
172 P A -0.0947
173 A A -0.9140
174 K A -1.9530
175 T A -1.0323
176 P A -1.0592
177 P A -0.9043
178 A A -0.7329
179 P A -1.4507
180 K A -1.9537
181 T A -1.1301
182 P A -1.1685
183 P A -1.3931
184 S A 0.0000
185 S A -0.5657
186 G A -1.1422
187 E A -1.9452
188 P A -2.1707
189 P A -1.9082
190 K A -2.8543
191 S A -2.4948
192 G A -2.1181
193 D A -3.3937
194 R A -3.4745
195 S A 0.0000
196 G A -1.3191
197 Y A 0.0000
198 S A -0.6388
199 S A 0.0000
200 P A -0.7308
201 G A -0.9396
202 S A -0.4810
203 P A -0.5253
204 G A -1.1551
205 T A -0.9140
206 P A -0.9716
207 G A -0.5680
208 S A 0.0000
209 R A -1.0244
210 S A -1.0713
211 R A -2.0143
212 T A -1.2333
213 P A -1.2164
214 S A -1.1600
215 L A -1.2989
216 P A 0.0000
217 T A -2.1377
218 P A -2.1225
219 P A -1.1973
220 T A -1.4569
221 R A -3.2089
222 E A -3.1892
223 P A -2.9267
224 K A -3.1418
225 K A -2.3066
226 V A -0.6104
227 A A 0.3716
228 V A 1.8638
229 V A 1.7538
230 R A -0.9325
231 T A -1.2547
232 P A -1.2514
233 P A -1.5951
234 K A -2.1270
235 S A 0.0000
236 P A 0.0000
237 S A -0.7029
238 S A -1.0765
239 A A -0.9713
240 K A -1.2658
241 S A -1.8497
242 R A -2.3548
243 L A -0.8395
244 Q A -1.1934
245 T A -0.5522
246 A A -0.1382
247 P A -0.2574
248 V A -0.1010
249 P A 0.0000
250 M A -0.7443
251 P A -1.0616
252 D A -1.6621
253 L A -0.1440
254 K A -1.4176
255 N A -1.6599
256 V A -0.9252
257 K A -2.1017
258 S A -1.7748
259 K A -1.4277
260 I A 0.0242
261 G A -1.3344
262 S A -1.3048
263 T A -1.1153
264 E A -2.1304
265 N A -2.5536
266 L A -1.3047
267 K A -2.7769
268 H A -2.4777
269 Q A -2.0608
270 P A -1.7007
271 G A -1.9204
272 G A -1.1066
273 G A -0.4585
274 K A -0.5840
275 V A -0.2891
276 Q A -1.7844
277 I A -1.1328
278 I A 0.0000
279 N A -2.6700
280 K A -2.9144
281 K A -2.1719
282 L A -1.0489
283 D A 0.0000
284 L A -1.1733
285 S A -1.0326
286 N A -1.5708
287 V A -0.4832
288 Q A -0.9742
289 S A 0.0000
290 K A -1.9718
291 C A -1.5149
292 G A -1.8848
293 S A -1.8952
294 K A -2.3870
295 D A -2.1228
296 N A -1.3295
297 I A -0.5959
298 K A -1.7006
299 H A 0.0000
300 V A 0.0000
301 P A 0.1595
302 G A -0.7369
303 G A -0.8083
304 G A -0.2784
305 S A 0.2152
306 V A 1.6324
307 Q A 0.3595
308 I A 0.0000
309 V A 0.9002
310 Y A 0.7264
311 K A -1.0584
312 P A 0.0397
313 V A 1.1530
314 D A -0.6373
315 L A 0.4078
316 S A -0.5354
317 K A -1.6770
318 V A -0.2839
319 T A -0.2450
320 S A -0.8498
321 K A -1.5195
322 C A -0.5550
323 G A -0.0977
324 S A 0.0000
325 L A -0.0952
326 G A -0.6605
327 N A -0.7851
328 I A 0.6173
329 H A -0.8505
330 H A -1.2827
331 K A -0.9424
332 P A -1.0310
333 G A -1.5084
334 G A -1.4572
335 G A -1.8733
336 Q A -2.6622
337 V A -1.8343
338 E A -2.0805
339 V A -0.5496
340 K A -2.0135
341 S A -2.0272
342 E A -2.7264
343 K A -1.6276
344 L A -0.3090
345 D A -1.1587
346 F A 0.2842
347 K A -0.9125
348 D A -1.5531
349 R A -1.6083
350 V A 0.1642
351 Q A -1.1432
352 S A -0.8959
353 K A -0.6457
354 I A 0.7292
355 G A -0.2498
356 S A -0.3903
357 L A -0.7446
358 D A -1.7679
359 N A -0.8752
360 I A 0.9409
361 T A 0.2238
362 H A 0.1428
363 V A 1.4174
364 P A 0.1938
365 G A -0.8656
366 G A -1.5106
367 G A -1.8940
368 N A -2.4007
369 K A -2.6717
370 K A -1.7723
371 I A -0.3794
372 E A -1.6721
373 T A -1.4873
374 H A -1.7389
375 K A -1.4267
376 L A 0.7267
377 T A 0.5434
378 F A 0.5763
379 R A -1.8940
380 E A -3.0240
381 N A -2.6791
382 A A -2.1303
383 K A -2.7931
384 A A -1.7959
385 K A -2.6890
386 T A -1.8782
387 D A -2.1074
388 H A -2.1074
389 G A -0.9986
390 A A -0.4841
391 E A -0.8622
392 I A 0.1250
393 V A 0.2140
394 Y A -0.7116
395 K A -1.5795
396 S A -0.1402
397 P A 0.5670
398 V A 1.3627
399 V A 1.6950
400 S A 0.2724
401 G A -0.1462
402 D A -0.5476
403 T A -0.6240
404 S A -0.5127
405 P A -0.6757
406 R A -1.5740
407 H A -1.0684
408 L A 0.2191
409 S A -0.4979
410 N A -1.2310
411 V A -0.6389
412 S A -0.7271
413 S A -0.5410
414 T A 0.1085
415 G A 0.0000
416 S A 0.5568
417 I A 1.5714
418 D A -0.2799
419 M A 0.7697
420 V A 0.1814
421 D A -1.0832
422 S A -0.6927
423 P A -0.2733
424 Q A -0.8529
425 L A 0.0000
426 A A 0.5631
427 T A 0.2766
428 L A 0.7773
429 A A -0.3235
430 D A -1.8533
431 E A -1.7147
432 V A 0.2825
433 S A -0.3687
434 A A -0.1539
435 S A -0.2224
436 L A -0.5392
437 A A -0.8293
438 K A -1.8902
439 Q A -1.0247
440 G A -0.5137
441 L A 0.8314
1 M B -0.1894
2 A B -1.9065
3 D B -3.7285
4 E B -3.8741
5 E B -4.0423
6 K B -3.5655
7 L B -2.1105
8 P B -1.4619
9 P B -0.5298
10 G B -0.3992
11 W B -1.5015
12 E B -2.8603
13 K B -2.2874
14 R B -1.9518
15 M B -0.6133
16 S B -1.2982
17 R B -2.2745
18 S B -1.3698
19 S B -1.3512
20 G B -1.4148
21 R B -1.7598
22 V B -0.3779
23 Y B -1.0203
24 Y B -1.3833
25 F B -1.2846
26 N B -0.9134
27 H B -0.9226
28 I B 0.7071
29 T B -0.4846
30 N B -0.8942
31 A B -0.6041
32 S B -1.0572
33 Q B -0.8771
34 W B -0.8686
35 E B -2.3677
36 R B -3.5213
37 P B -2.3721
38 S B -2.4459
39 G B -3.2361
40 N B -2.5825
41 S B -1.3842
42 S B -1.0189
43 S B -1.2083
44 G B -2.1474
45 G B -2.0836
46 K B -2.8630
47 N B -2.8907
48 G B -2.4301
49 Q B -2.3559
50 G B -2.2178
51 E B -2.7046
52 P B -2.3119
53 A B -2.1829
54 R B -2.9704
55 V B 0.0000
56 R B -1.9138
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 -1.8847
65 S B -2.0117
66 Q B -2.4106
67 S B 0.0000
68 R B -3.6254
69 R B -3.7625
70 P B -2.9590
71 S B -2.5809
72 S B -1.2843
73 W B 0.0273
74 R B -1.4578
75 Q B -2.6841
76 E B -3.4560
77 K B -3.4670
78 I B 0.0000
79 T B -1.6848
80 R B -2.0373
81 T B -2.3434
82 K B -3.2948
83 E B -3.5903
84 E B -2.9141
85 A B 0.0000
86 L B -2.0310
87 E B -2.9548
88 L B -1.1609
89 I B 0.0000
90 N B -2.0583
91 G B -1.6875
92 Y B 0.0000
93 I B -1.8732
94 Q B -2.9317
95 K B -3.6597
96 I B 0.0000
97 K B -3.3604
98 S B -2.9069
99 G B -3.0757
100 E B -3.7020
101 E B -3.6271
102 D B -3.8755
103 F B 0.0000
104 E B -3.2080
105 S B -2.2242
106 L B 0.0000
107 A B 0.0000
108 S B 0.0000
109 Q B -1.4981
110 F B -0.2795
111 S B 0.0000
112 D B 0.0000
113 C B -0.0881
114 S B -0.5378
115 S B 0.0000
116 A B -1.6964
117 K B -2.0705
118 A B -1.7762
119 R B -2.7790
120 G B 0.0000
121 D B -1.2904
122 L B -0.2579
123 G B -0.7103
124 A B -1.3579
125 F B 0.0000
126 S B -2.2123
127 R B -2.8953
128 G B -2.6417
129 Q B -2.0925
130 M B -1.1664
131 Q B -1.9598
132 K B -2.5449
133 P B -1.1358
134 F B 0.0000
135 E B 0.0000
136 D B -1.9712
137 A B -0.8907
138 S B 0.0000
139 F B -0.8808
140 A B -0.4650
141 L B -0.7734
142 R B -2.0892
143 T B -1.8232
144 G B -1.6099
145 E B -1.3953
146 M B -0.5626
147 S B 0.0000
148 G B -0.1654
149 P B 0.0497
150 V B 0.6785
151 F B 1.0590
152 T B -0.5465
153 D B -2.5148
154 S B -1.8570
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 -0.8312
161 R B -1.4306
162 T B -1.7908
163 E B -2.8116

 

Laboratory of Theory of Biopolymers 2015