Project name: Full TAU and Pin1 5

Status: done

submitted: 2019-02-20 01:31:44, status changed: 2019-02-20 01:51:51
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Chain sequence(s) A: MAEPRQEFEVMEDHAGTYGLGDRKDQGGYTMHQDQEGDTDAGLKESPLQTPTEDGSEEPGSETSDAKSTPTAEDVTAPLVDEGAPGKQAAAQPHTEIPEGTTAEEAGIGDTPSLEDEAAGHVTQARMVSKSKDGTGSDDKKAKGADGKTKIATPRGAAPPGQKGQANATRIPAKTPPAPKTPPSSGEPPKSGDRSGYSSPGSPGTPGSRSRTPSLPTPPTREPKKVAVVRTPPKSPSSAKSRLQTAPVPMPDLKNVKSKIGSTENLKHQPGGGKVQIINKKLDLSNVQSKCGSKDNIKHVPGGGSVQIVYKPVDLSKVTSKCGSLGNIHHKPGGGQVEVKSEKLDFKDRVQSKIGSLDNITHVPGGGNKKIETHKLTFRENAKAKTDHGAEIVYKSPVVSGDTSPRHLSNVSSTGSIDMVDSPQLATLADEVSASLAKQGL
B: MADEEKLPPGWEKRMSRSSGRVYYFNHITNASQWERPSGNSSSGGKNGQGEPARVRCSHLLVKHSQSRRPSSWRQEKITRTKEEALELINGYIQKIKSGEEDFESLASQFSDCSSAKARGDLGAFSRGQMQKPFEDASFALRTGEMSGPVFTDSGIHIILRTE
Distance of aggregation 5 Å
Dynamic mode No
Show buried residues

Minimal score value
-2.3822
Maximal score value
2.0955
Average score
-0.4785
Total score value
-289.0002

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 1.0550
2 A A -0.1309
3 E A -1.8630
4 P A -0.9037
5 R A -2.1001
6 Q A -1.5715
7 E A -0.4814
8 F A 0.0000
9 E A -0.2161
10 V A 0.0000
11 M A -0.1776
12 E A -2.1291
13 D A -2.1162
14 H A 0.0000
15 A A -0.0047
16 G A -0.3937
17 T A -0.1891
18 Y A 0.1460
19 G A 0.0000
20 L A 0.8203
21 G A -0.4857
22 D A -2.0511
23 R A -1.7511
24 K A -2.1140
25 D A -1.4009
26 Q A 0.0000
27 G A 0.0000
28 G A -0.1234
29 Y A 1.2258
30 T A 0.4079
31 M A 0.9714
32 H A -0.1512
33 Q A -1.5418
34 D A -2.0020
35 Q A 0.0000
36 E A -0.4312
37 G A -0.5047
38 D A -1.7577
39 T A -0.7165
40 D A -1.8222
41 A A -0.3792
42 G A -0.0755
43 L A 1.1685
44 K A -1.7396
45 E A -2.1389
46 S A -0.4280
47 P A 0.0857
48 L A 1.4896
49 Q A 0.1440
50 T A 0.0000
51 P A 0.0000
52 T A -0.3423
53 E A -1.8691
54 D A -0.6094
55 G A -0.1722
56 S A -0.5727
57 E A -1.9642
58 E A -0.9373
59 P A -0.3429
60 G A -0.2672
61 S A -0.5798
62 E A -1.8652
63 T A -0.4241
64 S A -0.5573
65 D A -1.8190
66 A A -0.5576
67 K A -1.6994
68 S A -0.3785
69 T A -0.0933
70 P A -0.2612
71 T A 0.0000
72 A A 0.0000
73 E A -0.6263
74 D A -0.7420
75 V A 0.4855
76 T A 0.0559
77 A A 0.0657
78 P A 0.0298
79 L A 1.7141
80 V A 1.1231
81 D A -1.9016
82 E A -2.2273
83 G A -0.7828
84 A A -0.0708
85 P A -0.3275
86 G A -0.8126
87 K A -1.9981
88 Q A -1.4935
89 A A -0.1473
90 A A 0.0797
91 A A -0.1484
92 Q A -1.2053
93 P A -0.4934
94 H A -1.0201
95 T A -0.5709
96 E A -1.7507
97 I A 0.1041
98 P A -0.3704
99 E A -1.8552
100 G A -0.4105
101 T A -0.0572
102 T A -0.0739
103 A A -0.3442
104 E A -2.1647
105 E A -2.1382
106 A A -0.3685
107 G A -0.0370
108 I A 1.1636
109 G A -0.5682
110 D A -1.8290
111 T A -0.3873
112 P A -0.2946
113 S A -0.2127
114 L A -0.1086
115 E A -2.0235
116 D A -1.7399
117 E A -0.6426
118 A A 0.0000
119 A A -0.0284
120 G A -0.6737
121 H A -0.7611
122 V A 1.5978
123 T A 0.0981
124 Q A -1.1940
125 A A -0.2283
126 R A 0.0000
127 M A 0.7455
128 V A 1.1866
129 S A -0.3243
130 K A -1.7517
131 S A -0.6774
132 K A -2.0235
133 D A -2.2041
134 G A -0.8077
135 T A -0.2126
136 G A -0.3329
137 S A -0.4283
138 D A -2.1395
139 D A -2.2229
140 K A -0.8878
141 K A -0.5066
142 A A 0.0000
143 K A -0.6021
144 G A -0.5330
145 A A -0.3734
146 D A -1.8674
147 G A -1.0854
148 K A -1.7875
149 T A -0.6474
150 K A -1.3726
151 I A 1.5009
152 A A 0.3692
153 T A -0.0763
154 P A -0.4442
155 R A -1.9413
156 G A -0.7852
157 A A -0.0215
158 A A -0.2307
159 P A -0.2989
160 P A -0.3806
161 G A -0.6176
162 Q A -1.2926
163 K A -1.9238
164 G A -0.9981
165 Q A -1.3608
166 A A -0.3779
167 N A -1.2524
168 A A -0.1840
169 T A -0.3957
170 R A -1.4868
171 I A 1.6167
172 P A 0.1594
173 A A -0.2966
174 K A -1.6984
175 T A -0.1679
176 P A -0.2242
177 P A -0.2744
178 A A -0.0334
179 P A -0.5394
180 K A -1.7573
181 T A -0.4214
182 P A -0.2291
183 P A -0.1473
184 S A 0.0000
185 S A -0.2769
186 G A -0.4607
187 E A -0.4413
188 P A -0.3331
189 P A -0.4875
190 K A -1.7752
191 S A -0.5417
192 G A -0.4716
193 D A -2.1428
194 R A -2.1672
195 S A 0.0000
196 G A -0.0942
197 Y A 0.0000
198 S A -0.1025
199 S A 0.0000
200 P A -0.2327
201 G A -0.5916
202 S A -0.3182
203 P A -0.2015
204 G A -0.3395
205 T A -0.1749
206 P A -0.3234
207 G A -0.1997
208 S A 0.0000
209 R A -0.2361
210 S A -0.3410
211 R A -1.4096
212 T A -0.2824
213 P A -0.0751
214 S A -0.0202
215 L A 0.2273
216 P A 0.0000
217 T A -0.2025
218 P A -0.7443
219 P A -0.2945
220 T A -0.4166
221 R A -2.1948
222 E A -2.1804
223 P A -0.6017
224 K A -1.7466
225 K A -1.8930
226 V A 0.0628
227 A A 0.4464
228 V A 2.0955
229 V A 1.7565
230 R A -1.5408
231 T A -0.4355
232 P A -0.2522
233 P A -0.5948
234 K A -1.7456
235 S A 0.0000
236 P A 0.0000
237 S A 0.0021
238 S A 0.0079
239 A A -0.0704
240 K A -0.5819
241 S A -0.6453
242 R A -1.6025
243 L A 0.9983
244 Q A -0.9317
245 T A -0.2804
246 A A -0.0402
247 P A -0.1754
248 V A 0.2678
249 P A 0.0000
250 M A 0.1938
251 P A -0.3988
252 D A -1.5765
253 L A 0.8350
254 K A -0.8029
255 N A -1.3343
256 V A -0.0973
257 K A -1.6463
258 S A -0.7881
259 K A -1.4024
260 I A 1.4106
261 G A 0.1161
262 S A -0.2545
263 T A -0.4448
264 E A -2.0695
265 N A -1.3342
266 L A 1.0205
267 K A -1.6026
268 H A -1.5076
269 Q A -1.4223
270 P A -0.5556
271 G A -0.5671
272 G A -0.4001
273 G A -0.2542
274 K A -0.1704
275 V A 0.2823
276 Q A -1.0238
277 I A 0.2064
278 I A 0.0000
279 N A -1.5788
280 K A -2.0730
281 K A -1.0618
282 L A 0.0826
283 D A 0.0000
284 L A 0.0506
285 S A -0.4039
286 N A -1.1884
287 V A 0.1378
288 Q A -0.1344
289 S A 0.0000
290 K A -1.0504
291 C A -0.0670
292 G A -0.1750
293 S A -0.1643
294 K A -1.1932
295 D A -1.1140
296 N A -0.1467
297 I A 0.5374
298 K A -1.3681
299 H A 0.0000
300 V A 0.0000
301 P A 0.0497
302 G A -0.2656
303 G A -0.5814
304 G A -0.5608
305 S A 0.1696
306 V A 1.5547
307 Q A -0.1852
308 I A 0.0000
309 V A 0.9287
310 Y A 1.0974
311 K A -1.5060
312 P A -0.2292
313 V A 1.4179
314 D A -1.1465
315 L A 1.2016
316 S A -0.2408
317 K A -1.6625
318 V A 0.1173
319 T A 0.1889
320 S A -0.5151
321 K A -1.7091
322 C A -0.1606
323 G A -0.0263
324 S A 0.0000
325 L A 0.1778
326 G A -0.6046
327 N A -0.7133
328 I A 1.6614
329 H A -0.8079
330 H A -1.1996
331 K A -0.3658
332 P A -0.1516
333 G A -0.5585
334 G A -0.5826
335 G A -0.4273
336 Q A -1.0320
337 V A -0.0753
338 E A -1.2161
339 V A 1.1832
340 K A -1.4043
341 S A -0.7569
342 E A -1.9043
343 K A -0.4053
344 L A 1.1673
345 D A -1.1909
346 F A 1.3733
347 K A -0.3157
348 D A -1.1582
349 R A -1.6609
350 V A 1.2744
351 Q A -0.7214
352 S A -0.4999
353 K A -0.9422
354 I A 1.7336
355 G A 0.0982
356 S A 0.0393
357 L A 0.5427
358 D A -1.8664
359 N A -1.2508
360 I A 1.7745
361 T A 0.1166
362 H A -0.6817
363 V A 1.5476
364 P A -0.0211
365 G A -0.5972
366 G A -0.6336
367 G A -0.7757
368 N A -1.6199
369 K A -1.9083
370 K A -1.1261
371 I A 1.4670
372 E A -1.4651
373 T A -0.5803
374 H A -1.3104
375 K A -1.5947
376 L A 1.2230
377 T A 0.5533
378 F A 1.5934
379 R A -1.8204
380 E A -2.3822
381 N A -1.5904
382 A A -0.4719
383 K A -1.6790
384 A A -0.5496
385 K A -1.6955
386 T A -0.4894
387 D A -1.6610
388 H A -1.4076
389 G A -0.4823
390 A A -0.3616
391 E A -1.4483
392 I A 1.4808
393 V A 1.0226
394 Y A 0.9956
395 K A -1.5098
396 S A -0.5470
397 P A 0.0142
398 V A 1.4517
399 V A 1.9429
400 S A 0.0233
401 G A -0.6064
402 D A -0.6361
403 T A -0.1820
404 S A -0.1065
405 P A -0.2997
406 R A -1.3396
407 H A -0.9277
408 L A 1.2657
409 S A -0.1612
410 N A -1.2384
411 V A 0.1622
412 S A 0.0196
413 S A -0.0663
414 T A -0.0186
415 G A 0.0000
416 S A 0.4419
417 I A 1.6867
418 D A -1.2471
419 M A 0.8665
420 V A 0.7006
421 D A -0.9895
422 S A -0.2607
423 P A -0.3395
424 Q A -1.2185
425 L A 0.0000
426 A A 0.0455
427 T A 0.1877
428 L A 1.2981
429 A A -0.0783
430 D A -2.1090
431 E A -1.8164
432 V A 1.4078
433 S A 0.1089
434 A A -0.0178
435 S A -0.1491
436 L A 0.2697
437 A A -0.1954
438 K A -1.7244
439 Q A -0.5189
440 G A -0.0009
441 L A 0.5597
1 M B 1.0555
2 A B -0.2566
3 D B -1.9061
4 E B -1.3488
5 E B -2.2703
6 K B -1.9568
7 L B 0.2018
8 P B -0.1266
9 P B -0.2871
10 G B -0.2810
11 W B -0.2441
12 E B -2.0355
13 K B -1.8518
14 R B -1.3018
15 M B 0.9433
16 S B -0.1904
17 R B -1.8874
18 S B -0.5888
19 S B -0.3340
20 G B -0.8447
21 R B -1.7580
22 V B 0.7791
23 Y B 0.4453
24 Y B 0.1047
25 F B 0.2314
26 N B -0.2586
27 H B -0.7940
28 I B 1.7052
29 T B 0.1783
30 N B -0.9488
31 A B -0.1708
32 S B -0.1871
33 Q B -0.6982
34 W B -0.0673
35 E B -1.9842
36 R B -1.6411
37 P B -0.2819
38 S B -0.1717
39 G B -0.9206
40 N B -1.3438
41 S B -0.4856
42 S B -0.2911
43 S B -0.3223
44 G B -0.5028
45 G B -0.8497
46 K B -1.9595
47 N B -1.3407
48 G B -0.8625
49 Q B -1.3711
50 G B -1.0251
51 E B -1.9262
52 P B -0.4384
53 A B -0.3093
54 R B -1.6292
55 V B 0.0000
56 R B -1.0006
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 -0.2020
65 S B -0.3807
66 Q B -1.2225
67 S B 0.0000
68 R B -2.1831
69 R B -2.1902
70 P B -0.4025
71 S B -0.4133
72 S B 0.1333
73 W B 1.0306
74 R B -0.7997
75 Q B -1.6809
76 E B -2.3750
77 K B -2.0351
78 I B 0.0000
79 T B -0.1788
80 R B -0.4764
81 T B -0.5062
82 K B -2.0419
83 E B -2.2661
84 E B -1.2611
85 A B 0.0000
86 L B 0.0949
87 E B -1.7592
88 L B -0.0067
89 I B 0.0000
90 N B -0.9963
91 G B -0.2637
92 Y B 0.0000
93 I B 0.0313
94 Q B -1.3612
95 K B -1.4376
96 I B 0.0000
97 K B -1.7391
98 S B -0.7305
99 G B -0.8418
100 E B -2.0109
101 E B -1.3478
102 D B -1.8942
103 F B 0.0000
104 E B -1.9683
105 S B -0.4228
106 L B 0.0000
107 A B 0.0000
108 S B 0.0000
109 Q B -1.0666
110 F B 0.3201
111 S B 0.0000
112 D B 0.0000
113 C B 0.2007
114 S B -0.1687
115 S B 0.0000
116 A B -0.4896
117 K B -1.6936
118 A B -0.5479
119 R B -1.4345
120 G B 0.0000
121 D B -0.1988
122 L B 0.4493
123 G B -0.1097
124 A B -0.1600
125 F B 0.0000
126 S B -0.5989
127 R B -1.8834
128 G B -0.6152
129 Q B -0.4521
130 M B 0.1275
131 Q B -0.7009
132 K B -1.1675
133 P B -0.3341
134 F B 0.0000
135 E B 0.0000
136 D B -1.5361
137 A B -0.2639
138 S B 0.0000
139 F B 0.5783
140 A B 0.2168
141 L B -0.0408
142 R B -1.8042
143 T B -0.4933
144 G B -0.5036
145 E B -0.2928
146 M B 0.1722
147 S B 0.0000
148 G B -0.3064
149 P B -0.1184
150 V B 0.4803
151 F B 1.5895
152 T B -0.0452
153 D B -1.7957
154 S B -0.3561
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 0.1549
161 R B -0.1941
162 T B -0.4071
163 E B -1.8257

 

Laboratory of Theory of Biopolymers 2015