Project name: Tau PHF [mutate: IB308K, IJ308K]

Status: done

submitted: 2019-02-24 12:03:20, status changed: 2019-02-24 12:45:23
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Chain sequence(s) A: VQIVYKPVDLSKVTSKCGSLGNIHHKPGGGQVEVKSEKLDFKDRVQSKIGSLDNITHVPGGGNKKIETHKLTF
C: VQIVYKPVDLSKVTSKCGSLGNIHHKPGGGQVEVKSEKLDFKDRVQSKIGSLDNITHVPGGGNKKIETHKLTF
B: VQIVYKPVDLSKVTSKCGSLGNIHHKPGGGQVEVKSEKLDFKDRVQSKIGSLDNITHVPGGGNKKIETHKLTF
E: VQIVYKPVDLSKVTSKCGSLGNIHHKPGGGQVEVKSEKLDFKDRVQSKIGSLDNITHVPGGGNKKIETHKLTF
D: VQIVYKPVDLSKVTSKCGSLGNIHHKPGGGQVEVKSEKLDFKDRVQSKIGSLDNITHVPGGGNKKIETHKLTF
G: VQIVYKPVDLSKVTSKCGSLGNIHHKPGGGQVEVKSEKLDFKDRVQSKIGSLDNITHVPGGGNKKIETHKLTF
F: VQIVYKPVDLSKVTSKCGSLGNIHHKPGGGQVEVKSEKLDFKDRVQSKIGSLDNITHVPGGGNKKIETHKLTF
I: VQIVYKPVDLSKVTSKCGSLGNIHHKPGGGQVEVKSEKLDFKDRVQSKIGSLDNITHVPGGGNKKIETHKLTF
H: VQIVYKPVDLSKVTSKCGSLGNIHHKPGGGQVEVKSEKLDFKDRVQSKIGSLDNITHVPGGGNKKIETHKLTF
J: VQIVYKPVDLSKVTSKCGSLGNIHHKPGGGQVEVKSEKLDFKDRVQSKIGSLDNITHVPGGGNKKIETHKLTF
Distance of aggregation 10 Å
Dynamic mode No
Mutated residues IB308K, IJ308K
Energy difference between WT (input) and mutated protein (by FoldX) 2.25465 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
-5.5212
Maximal score value
2.6839
Average score
-0.7862
Total score value
-573.9527

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
306 V A 1.9555
307 Q A 0.5729
308 I A 1.4469
309 V A 1.2523
310 Y A 0.3177
311 K A -1.2222
312 P A -0.2959
313 V A 0.8863
314 D A -0.1897
315 L A 0.8683
316 S A -0.6312
317 K A -1.5368
318 V A -1.0620
319 T A -1.3472
320 S A -1.5811
321 K A -2.4652
322 C A -1.1728
323 G A -1.0682
324 S A -0.6347
325 L A -0.0103
326 G A -0.7593
327 N A -1.5296
328 I A -0.5645
329 H A -1.1920
330 H A -0.6559
331 K A -1.3700
332 P A -0.9067
333 G A -1.0342
334 G A -0.9889
335 G A -1.0608
336 Q A -1.6851
337 V A -1.0918
338 E A -2.2889
339 V A -1.6314
340 K A -2.9803
341 S A -2.6608
342 E A -3.6299
343 K A -3.4456
344 L A -1.9004
345 D A -2.7221
346 F A -2.8432
347 K A -4.0059
348 D A -3.8525
349 R A -4.0962
350 V A -2.6595
351 Q A -2.7479
352 S A -1.6016
353 K A -2.1089
354 I A -1.0215
355 G A -1.0103
356 S A -0.8215
357 L A -0.1840
358 D A -0.2067
359 N A 0.1145
360 I A 1.2390
361 T A 0.0000
362 H A -0.4624
363 V A -0.0392
364 P A -0.3790
365 G A 0.0000
366 G A -1.1997
367 G A -1.1121
368 N A -1.5581
369 K A -2.2977
370 K A -1.2958
371 I A 0.1014
372 E A -0.5217
373 T A -0.6509
374 H A -1.1901
375 K A -2.0630
376 L A -0.3171
377 T A 0.5385
378 F A 1.8382
306 V B 1.7639
307 Q B 0.1804
308 K B 0.7784 mutated: IB308K
309 V B 0.9289
310 Y B 0.1918
311 K B -1.1596
312 P B -0.2267
313 V B 1.0235
314 D B 0.1162
315 L B 0.9888
316 S B -0.5794
317 K B -1.6450
318 V B -0.9195
319 T B -1.2676
320 S B -1.4086
321 K B -2.2905
322 C B -1.0166
323 G B -0.9552
324 S B -0.5324
325 L B 0.1962
326 G B -0.6403
327 N B -1.4709
328 I B -0.6374
329 H B -1.1965
330 H B -0.7919
331 K B -1.1862
332 P B -0.9391
333 G B -0.9257
334 G B -0.7148
335 G B -0.6219
336 Q B -0.8842
337 V B -0.7793
338 E B -2.1937
339 V B -1.5788
340 K B -2.9810
341 S B -2.6389
342 E B -3.6809
343 K B -3.5900
344 L B -2.0101
345 D B -2.8552
346 F B -2.8400
347 K B -3.9838
348 D B -3.7106
349 R B -4.0010
350 V B -2.6116
351 Q B -2.7570
352 S B -1.5863
353 K B -2.1014
354 I B -0.9878
355 G B -0.9416
356 S B -0.8102
357 L B -0.0874
358 D B -0.4131
359 N B -0.0764
360 I B 1.1311
361 T B 0.0000
362 H B -0.4408
363 V B -0.0252
364 P B -0.3525
365 G B 0.0000
366 G B -1.0888
367 G B -1.0724
368 N B -1.3587
369 K B -1.9272
370 K B -0.6543
371 I B 0.4403
372 E B -0.3717
373 T B -0.6430
374 H B -1.1878
375 K B -2.1054
376 L B -0.2475
377 T B 0.7595
378 F B 2.3203
306 V C 2.5280
307 Q C 1.0562
308 I C 0.0000
309 V C 0.1753
310 Y C 0.0000
311 K C -1.0155
312 P C 0.0000
313 V C 0.5495
314 D C 0.6361
315 L C 0.8217
316 S C 0.0000
317 K C -1.1264
318 V C 0.0000
319 T C -1.6135
320 S C 0.0000
321 K C -2.9870
322 C C 0.0000
323 G C -1.2801
324 S C -0.6836
325 L C 0.0000
326 G C -0.9327
327 N C -1.5326
328 I C 0.0000
329 H C -0.9911
330 H C 0.0000
331 K C 0.0000
332 P C 0.0000
333 G C 0.0000
334 G C 0.0000
335 G C 0.0000
336 Q C 0.0000
337 V C 0.0000
338 E C -1.5657
339 V C 0.0000
340 K C -2.7175
341 S C -2.8478
342 E C -3.3942
343 K C -3.4050
344 L C 0.0000
345 D C -2.7845
346 F C 0.0000
347 K C -4.1398
348 D C -4.4412
349 R C -5.1444
350 V C 0.0000
351 Q C -2.8963
352 S C -1.5141
353 K C -1.3964
354 I C 0.0000
355 G C 0.0000
356 S C 0.0000
357 L C 0.0000
358 D C 0.0000
359 N C 0.0000
360 I C 0.5651
361 T C 0.0000
362 H C -0.2718
363 V C 0.0000
364 P C 0.0000
365 G C 0.0000
366 G C 0.0000
367 G C -0.9949
368 N C 0.0000
369 K C -1.8905
370 K C 0.0000
371 I C 0.0362
372 E C 0.0000
373 T C -0.4902
374 H C 0.0000
375 K C -1.6355
376 L C 0.0000
377 T C 0.5927
378 F C 1.9239
306 V D 2.3200
307 Q D 0.8717
308 I D 0.0000
309 V D 0.0349
310 Y D 0.0000
311 K D -0.8598
312 P D 0.0000
313 V D 0.5292
314 D D 0.0000
315 L D 0.9218
316 S D 0.0000
317 K D -1.5734
318 V D 0.0000
319 T D -1.5972
320 S D 0.0000
321 K D -2.5082
322 C D 0.0000
323 G D -1.1693
324 S D -0.5799
325 L D 0.0000
326 G D -0.8287
327 N D -1.4241
328 I D 0.0000
329 H D -0.9996
330 H D 0.0000
331 K D 0.0000
332 P D 0.0000
333 G D 0.0000
334 G D 0.0000
335 G D 0.0000
336 Q D 0.0000
337 V D 0.0000
338 E D -1.5715
339 V D 0.0000
340 K D -2.8343
341 S D 0.0000
342 E D -3.5506
343 K D -3.6478
344 L D 0.0000
345 D D -3.1275
346 F D 0.0000
347 K D -4.3728
348 D D -4.3070
349 R D -5.1034
350 V D 0.0000
351 Q D -2.9402
352 S D 0.0000
353 K D -1.3757
354 I D 0.0000
355 G D 0.0000
356 S D 0.0000
357 L D 0.0000
358 D D 0.0000
359 N D 0.0000
360 I D 0.5032
361 T D 0.0000
362 H D -0.3050
363 V D 0.0000
364 P D 0.0000
365 G D 0.0000
366 G D 0.0000
367 G D -0.9492
368 N D 0.0000
369 K D -1.5603
370 K D 0.0000
371 I D 0.1924
372 E D 0.0000
373 T D -0.5327
374 H D 0.0000
375 K D -1.7762
376 L D 0.0000
377 T D 0.6516
378 F D 1.9867
306 V E 2.6839
307 Q E 0.7531
308 I E 0.0000
309 V E -0.0904
310 Y E 0.0000
311 K E -1.4675
312 P E 0.0000
313 V E 0.6980
314 D E 0.0000
315 L E 1.1723
316 S E 0.0000
317 K E -1.3218
318 V E 0.0000
319 T E 0.0000
320 S E 0.0000
321 K E -2.6477
322 C E 0.0000
323 G E -1.3096
324 S E -0.6646
325 L E 0.0000
326 G E -1.0332
327 N E -1.5697
328 I E 0.0000
329 H E -0.7283
330 H E 0.0000
331 K E 0.0000
332 P E 0.0000
333 G E 0.0000
334 G E 0.0000
335 G E 0.0000
336 Q E 0.0000
337 V E 0.0000
338 E E -0.9824
339 V E 0.0000
340 K E -2.0122
341 S E -2.5601
342 E E -3.0916
343 K E -2.9997
344 L E 0.0000
345 D E -2.6394
346 F E 0.0000
347 K E -3.8893
348 D E -4.2934
349 R E -5.0429
350 V E 0.0000
351 Q E -2.5643
352 S E 0.0000
353 K E -1.1230
354 I E 0.0000
355 G E 0.0000
356 S E 0.0000
357 L E 0.0000
358 D E 0.0000
359 N E 0.0000
360 I E 0.5110
361 T E 0.0000
362 H E -0.4770
363 V E 0.0000
364 P E 0.0000
365 G E 0.0000
366 G E 0.0000
367 G E -0.6861
368 N E 0.0000
369 K E -1.8195
370 K E 0.0000
371 I E 0.2812
372 E E 0.0000
373 T E -0.3120
374 H E 0.0000
375 K E -1.4171
376 L E 0.0000
377 T E 0.5607
378 F E 1.7546
306 V F 2.6771
307 Q F 0.7383
308 I F 0.0000
309 V F 0.0558
310 Y F 0.0000
311 K F -1.2690
312 P F 0.0000
313 V F 0.6998
314 D F 0.0000
315 L F 1.1552
316 S F 0.0000
317 K F -1.5844
318 V F 0.0000
319 T F 0.0000
320 S F 0.0000
321 K F -2.5083
322 C F 0.0000
323 G F -1.2654
324 S F -0.6929
325 L F 0.0000
326 G F -1.0493
327 N F -1.5852
328 I F 0.0000
329 H F -0.7492
330 H F 0.0000
331 K F 0.0000
332 P F 0.0000
333 G F 0.0000
334 G F 0.0000
335 G F 0.0000
336 Q F 0.0000
337 V F 0.0000
338 E F -1.0151
339 V F 0.0000
340 K F -2.4593
341 S F -2.8538
342 E F -3.4041
343 K F -3.1571
344 L F 0.0000
345 D F -2.9674
346 F F 0.0000
347 K F -4.5765
348 D F -4.8816
349 R F -5.3105
350 V F 0.0000
351 Q F -2.5888
352 S F 0.0000
353 K F -1.0396
354 I F 0.0000
355 G F 0.0000
356 S F 0.0000
357 L F 0.0000
358 D F 0.0000
359 N F 0.0000
360 I F 0.5145
361 T F 0.0000
362 H F -0.4676
363 V F 0.0000
364 P F 0.0000
365 G F 0.0000
366 G F 0.0000
367 G F -0.6744
368 N F 0.0000
369 K F -1.7844
370 K F 0.0000
371 I F 0.3217
372 E F 0.0000
373 T F -0.3496
374 H F 0.0000
375 K F -1.6657
376 L F 0.0000
377 T F 0.5327
378 F F 1.9976
306 V G 2.6306
307 Q G 1.0053
308 I G 0.0000
309 V G -0.2812
310 Y G 0.0000
311 K G -1.5176
312 P G 0.0000
313 V G 0.3040
314 D G 0.0000
315 L G 0.6326
316 S G 0.0000
317 K G -1.1349
318 V G 0.0000
319 T G -1.3341
320 S G 0.0000
321 K G -2.6217
322 C G 0.0000
323 G G -1.1688
324 S G -0.7201
325 L G 0.0000
326 G G -1.0554
327 N G -1.4101
328 I G 0.0000
329 H G -0.8264
330 H G 0.0000
331 K G 0.0000
332 P G 0.0000
333 G G 0.0000
334 G G 0.0000
335 G G 0.0000
336 Q G 0.0000
337 V G 0.0000
338 E G -1.1426
339 V G 0.0000
340 K G -2.5615
341 S G -3.0093
342 E G -3.9077
343 K G -3.6679
344 L G 0.0000
345 D G -2.5951
346 F G 0.0000
347 K G -3.9642
348 D G -4.2127
349 R G -5.2040
350 V G 0.0000
351 Q G -2.7712
352 S G 0.0000
353 K G -1.1519
354 I G 0.0000
355 G G 0.0000
356 S G 0.0000
357 L G 0.0000
358 D G -0.6511
359 N G 0.0000
360 I G -0.1232
361 T G 0.0000
362 H G -0.4481
363 V G 0.0000
364 P G 0.0000
365 G G 0.0000
366 G G 0.0000
367 G G -0.9363
368 N G 0.0000
369 K G -2.2777
370 K G 0.0000
371 I G -0.5706
372 E G 0.0000
373 T G -0.8395
374 H G 0.0000
375 K G -1.7370
376 L G 0.0000
377 T G 0.8274
378 F G 2.1088
306 V H 2.2332
307 Q H 0.6435
308 I H 0.0000
309 V H -0.4022
310 Y H 0.0000
311 K H -0.9456
312 P H 0.0000
313 V H 0.6869
314 D H 0.0000
315 L H 0.8751
316 S H 0.0000
317 K H -1.2270
318 V H 0.0000
319 T H -1.4099
320 S H 0.0000
321 K H -2.6816
322 C H 0.0000
323 G H -1.3105
324 S H -0.7790
325 L H 0.0000
326 G H -1.1769
327 N H -1.6232
328 I H 0.0000
329 H H -1.0400
330 H H 0.0000
331 K H -1.0473
332 P H 0.0000
333 G H 0.0000
334 G H 0.0000
335 G H 0.0000
336 Q H 0.0000
337 V H 0.0000
338 E H -0.8795
339 V H 0.0000
340 K H -2.6370
341 S H 0.0000
342 E H -3.7803
343 K H -3.4755
344 L H 0.0000
345 D H -2.6236
346 F H 0.0000
347 K H -4.5742
348 D H -4.8199
349 R H -5.5212
350 V H 0.0000
351 Q H -2.7250
352 S H -1.1314
353 K H -0.8095
354 I H 0.0000
355 G H 0.0000
356 S H 0.0000
357 L H 0.0000
358 D H 0.0000
359 N H 0.0000
360 I H -0.1178
361 T H 0.0000
362 H H -0.3941
363 V H 0.0000
364 P H 0.0000
365 G H 0.0000
366 G H 0.0000
367 G H -0.9627
368 N H 0.0000
369 K H -2.3103
370 K H 0.0000
371 I H -0.5267
372 E H 0.0000
373 T H -0.6856
374 H H 0.0000
375 K H -1.7898
376 L H 0.0000
377 T H 0.7702
378 F H 2.0594
306 V I 2.0460
307 Q I 0.3516
308 I I 1.1172
309 V I -0.0752
310 Y I -0.1356
311 K I -1.6449
312 P I -0.9719
313 V I 0.4180
314 D I -0.4232
315 L I 0.6534
316 S I -0.8112
317 K I -1.5582
318 V I -1.4460
319 T I -1.2163
320 S I -1.3702
321 K I -2.0308
322 C I -1.2590
323 G I -1.1128
324 S I -0.8158
325 L I -0.4854
326 G I -1.2448
327 N I -1.6445
328 I I -0.7508
329 H I -0.9098
330 H I -0.5130
331 K I -0.8810
332 P I -0.5902
333 G I 0.0000
334 G I -0.6132
335 G I 0.0000
336 Q I -0.6536
337 V I -0.4066
338 E I -1.4646
339 V I -1.3369
340 K I -2.9412
341 S I -3.2277
342 E I -3.8477
343 K I -3.6946
344 L I -2.4765
345 D I -2.4798
346 F I -1.9232
347 K I -3.7309
348 D I -4.2771
349 R I -4.3992
350 V I -3.0291
351 Q I -2.6542
352 S I -1.4095
353 K I -1.7218
354 I I -0.2006
355 G I -0.6319
356 S I -0.7534
357 L I -0.4352
358 D I -1.6361
359 N I -1.0556
360 I I -0.1178
361 T I -0.2113
362 H I -0.8004
363 V I -0.1398
364 P I -0.4919
365 G I -0.7770
366 G I -0.7882
367 G I -1.0254
368 N I -2.0956
369 K I -2.9437
370 K I -2.7363
371 I I -1.2120
372 E I -1.3175
373 T I -1.1779
374 H I -1.9910
375 K I -2.1650
376 L I -0.0349
377 T I 1.0000
378 F I 2.4994
306 V J 1.7303
307 Q J -0.2095
308 K J 0.1110 mutated: IJ308K
309 V J -0.4360
310 Y J -0.1653
311 K J -1.2123
312 P J -0.3875
313 V J 1.1210
314 D J 0.2549
315 L J 1.1501
316 S J -0.5255
317 K J -1.2713
318 V J -1.3261
319 T J -1.2701
320 S J -1.5707
321 K J -2.5373
322 C J -1.5220
323 G J -1.2553
324 S J -0.9296
325 L J -0.6045
326 G J -1.3483
327 N J -1.7380
328 I J -0.7897
329 H J -1.1640
330 H J -0.9868
331 K J -1.8404
332 P J -1.1730
333 G J -0.8078
334 G J -0.8844
335 G J -0.3383
336 Q J -0.4267
337 V J -0.0010
338 E J -0.6527
339 V J -0.8699
340 K J -2.7040
341 S J -3.0029
342 E J -3.6090
343 K J -3.2385
344 L J -2.2970
345 D J -2.5245
346 F J -2.2289
347 K J -4.0593
348 D J -4.5920
349 R J -4.6131
350 V J -3.2121
351 Q J -2.5407
352 S J -1.0277
353 K J -0.8224
354 I J 0.3354
355 G J -0.0285
356 S J -0.1355
357 L J 0.0615
358 D J -1.3908
359 N J -1.1120
360 I J -0.1279
361 T J -0.2181
362 H J -0.7546
363 V J -0.0204
364 P J -0.4344
365 G J -0.8330
366 G J -0.8856
367 G J -1.0313
368 N J -2.1744
369 K J -2.9983
370 K J -2.7428
371 I J -1.1219
372 E J -1.0065
373 T J -0.8705
374 H J -1.4569
375 K J -2.1467
376 L J -0.2803
377 T J 0.8357
378 F J 2.3746

 

Laboratory of Theory of Biopolymers 2015