Project name: hemoglobin 1gzx

Status: done

submitted: 2018-02-20 07:24:28, status changed: 2018-02-20 07:39:45
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Chain sequence(s) A: VLSPADKTNVKAAWGKVGAHAGEYGAEALERMFLSFPTTKTYFPHFDLSHGSAQVKGHGKKVADALTNAVAHVDDMPNALSALSDLHAHKLRVDPVNFKLLSHCLLVTLAAHLPAEFTPAVHASLDKFLASVSTVLTSKYR
C: VLSPADKTNVKAAWGKVGAHAGEYGAEALERMFLSFPTTKTYFPHFDLSHGSAQVKGHGKKVADALTNAVAHVDDMPNALSALSDLHAHKLRVDPVNFKLLSHCLLVTLAAHLPAEFTPAVHASLDKFLASVSTVLTSKYR
B: VHLTPEEKSAVTALWGKVNVDEVGGEALGRLLVVYPWTQRFFESFGDLSTPDAVMGNPKVKAHGKKVLGAFSDGLAHLDNLKGTFATLSELHCDKLHVDPENFRLLGNVLVCVLAHHFGKEFTPPVQAAYQKVVAGVANALAHKYH
D: VHLTPEEKSAVTALWGKVNVDEVGGEALGRLLVVYPWTQRFFESFGDLSTPDAVMGNPKVKAHGKKVLGAFSDGLAHLDNLKGTFATLSELHCDKLHVDPENFRLLGNVLVCVLAHHFGKEFTPPVQAAYQKVVAGVANALAHKYH
Distance of aggregation 10 Å
Dynamic mode No
Show buried residues

Minimal score value
-4.008
Maximal score value
1.5271
Average score
-0.8268
Total score value
-474.58

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 V A 1.5271
2 L A 0.4956
3 S A 0.1032
4 P A -0.2427
5 A A -0.2807
6 D A 0.0000
7 K A -1.0389
8 T A -0.7688
9 N A -0.8770
10 V A 0.0000
11 K A -1.5966
12 A A -1.3174
13 A A 0.0000
14 W A 0.0000
15 G A -1.7811
16 K A -2.4103
17 V A 0.0000
18 G A -1.3702
19 A A -1.0409
20 H A -1.7990
21 A A -2.0980
22 G A -3.0728
23 E A -2.8613
24 Y A 0.0000
25 G A 0.0000
26 A A 0.0000
27 E A -1.2515
28 A A 0.0000
29 L A 0.0000
30 E A -0.6602
31 R A 0.0000
32 M A 0.0000
33 F A 0.0000
34 L A 0.3687
35 S A 0.1938
36 F A 0.2102
37 P A -0.2084
38 T A -0.3056
39 T A 0.0000
40 K A -0.4356
41 T A 0.0000
42 Y A 0.0639
43 F A -0.2296
44 P A -0.9610
45 H A -1.1161
46 F A -0.8332
47 D A -1.6339
48 L A -0.9196
49 S A -1.0809
50 H A -1.5979
51 G A -1.4433
52 S A 0.0000
53 A A -1.3987
54 Q A -1.7749
55 V A 0.0000
56 K A -3.3423
57 G A -2.6437
58 H A -2.2751
59 G A 0.0000
60 K A -4.0080
61 K A -3.3917
62 V A -1.9079
63 A A 0.0000
64 D A -3.0443
65 A A -1.7136
66 L A 0.0000
67 T A -1.5582
68 N A -1.5548
69 A A 0.0000
70 V A 0.0000
71 A A -1.1562
72 H A -1.9566
73 V A -1.7265
74 D A -2.7361
75 D A -2.7900
76 M A 0.0000
77 P A -1.4920
78 N A -2.0184
79 A A -1.5174
80 L A 0.0000
81 S A -0.7524
82 A A -0.3411
83 L A -0.1871
84 S A 0.0000
85 D A -1.6084
86 L A -0.8785
87 H A -0.8962
88 A A 0.0000
89 H A -2.2855
90 K A -2.2184
91 L A -0.8924
92 R A -1.0255
93 V A -0.0486
94 D A 0.0000
95 P A -0.0122
96 V A 0.2770
97 N A 0.0000
98 F A -0.1784
99 K A -1.0350
100 L A -0.0846
101 L A 0.0577
102 S A -0.3505
103 H A 0.0000
104 C A 0.0000
105 L A 0.0000
106 L A 0.0000
107 V A 0.0000
108 T A 0.0000
109 L A 0.0000
110 A A 0.0000
111 A A 0.0000
112 H A -1.1359
113 L A 0.0000
114 P A -0.6202
115 A A -0.3567
116 E A -0.9074
117 F A 0.0000
118 T A -0.2944
119 P A -0.3566
120 A A -0.3267
121 V A 0.0000
122 H A 0.0000
123 A A -0.1799
124 S A 0.0000
125 L A 0.0000
126 D A -0.2899
127 K A -0.1199
128 F A 0.0000
129 L A 0.0000
130 A A -0.3740
131 S A 0.2051
132 V A 0.0000
133 S A 0.0000
134 T A -0.1124
135 V A -0.3198
136 L A 0.0000
137 T A -0.4010
138 S A -0.3673
139 K A -0.9116
140 Y A 0.0000
141 R A -0.5266
144 V B -0.5451
145 H B -0.9372
146 L B -1.1914
147 T B -1.2223
148 P B -1.9191
149 E B -2.5196
150 E B -2.1194
151 K B -2.0429
152 S B -1.5747
153 A B -1.1254
154 V B 0.0000
155 T B -0.9310
156 A B -0.6493
157 L B 0.0000
158 W B -0.7352
159 G B -1.3310
160 K B -2.0436
161 V B 0.0000
162 N B -2.5135
163 V B -2.2226
164 D B -3.4432
165 E B -3.2515
166 V B 0.0000
167 G B 0.0000
168 G B 0.0000
169 E B -1.3664
170 A B 0.0000
171 L B 0.0000
172 G B 0.0000
173 R B 0.0000
174 L B 0.0000
175 L B 0.0000
176 V B -0.1134
177 V B 0.0000
178 Y B 0.0263
179 P B -0.3762
180 W B 0.0000
181 T B 0.0000
182 Q B -0.6080
183 R B -1.1580
184 F B -0.1472
185 F B -1.0576
186 E B -2.1133
187 S B -1.4414
188 F B -1.5355
189 G B -1.9970
190 D B -2.6982
191 L B -1.5028
192 S B -1.0817
193 T B -0.9549
194 P B -1.1697
195 D B -2.1486
196 A B -1.6572
197 V B 0.0000
198 M B -1.2045
199 G B -1.6999
200 N B -1.8663
201 P B -1.5572
202 K B -2.4002
203 V B 0.0000
204 K B -2.6531
205 A B -2.2713
206 H B -1.9290
207 G B 0.0000
208 K B -2.9860
209 K B -2.3600
210 V B -0.8571
211 L B 0.0000
212 G B -1.4701
213 A B -1.0232
214 F B 0.0000
215 S B -1.0352
216 D B -1.9416
217 G B 0.0000
218 L B -1.1374
219 A B -1.2420
220 H B -2.1145
221 L B 0.0000
222 D B -2.6724
223 N B -2.7111
224 L B 0.0000
225 K B -2.4823
226 G B -1.7671
227 T B -1.5768
228 F B 0.0000
229 A B -0.9564
230 T B -0.5321
231 L B -0.1360
232 S B 0.0000
233 E B -2.2389
234 L B -1.0865
235 H B -0.9572
236 C B 0.0000
237 D B -3.0040
238 K B -2.4608
239 L B -0.7518
240 H B -0.9664
241 V B -0.2689
242 D B 0.0000
243 P B -0.7313
244 E B -0.9340
245 N B 0.0000
246 F B -0.6968
247 R B -1.5865
248 L B -0.5058
249 L B -0.1860
250 G B 0.0000
251 N B -0.4601
252 V B 0.0000
253 L B 0.0000
254 V B 0.0000
255 C B 0.0000
256 V B 0.0000
257 L B 0.0000
258 A B 0.0000
259 H B -1.0199
260 H B -1.5900
261 F B -1.6806
262 G B -1.8684
263 K B -2.7932
264 E B -2.7473
265 F B 0.0000
266 T B -1.1686
267 P B -0.5408
268 P B -0.1828
269 V B 0.0000
270 Q B 0.0000
271 A B 0.0000
272 A B 0.0000
273 Y B 0.0000
274 Q B 0.0000
275 K B -0.6372
276 V B 0.0000
277 V B 0.0000
278 A B -0.7094
279 G B 0.0000
280 V B 0.0000
281 A B 0.0000
282 N B -1.7889
283 A B 0.0000
284 L B -0.9619
285 A B -1.4607
286 H B -1.9359
287 K B -1.9148
288 Y B -1.4890
289 H B -1.5476
401 V C 1.4930
402 L C 0.5178
403 S C 0.1316
404 P C -0.2468
405 A C -0.4358
406 D C 0.0000
407 K C -1.0054
408 T C -0.9573
409 N C -0.9344
410 V C 0.0000
411 K C -2.1030
412 A C -1.4824
413 A C 0.0000
414 W C 0.0000
415 G C -1.8229
416 K C -2.3965
417 V C 0.0000
418 G C -1.1916
419 A C -0.9208
420 H C -1.7195
421 A C -2.0048
422 G C -2.7546
423 E C -2.6256
424 Y C 0.0000
425 G C 0.0000
426 A C -1.9701
427 E C -1.1246
428 A C 0.0000
429 L C 0.0000
430 E C -0.6207
431 R C 0.0000
432 M C 0.0000
433 F C 0.0000
434 L C 0.4834
435 S C 0.2810
436 F C 0.2611
437 P C -0.1374
438 T C -0.2461
439 T C 0.0000
440 K C -0.2845
441 T C 0.0000
442 Y C 0.1113
443 F C -0.2493
444 P C -1.0338
445 H C -1.1906
446 F C -0.9885
447 D C -1.9055
448 L C -1.1083
449 S C -1.1851
450 H C -1.5987
451 G C -1.4355
452 S C 0.0000
453 A C -1.1754
454 Q C -1.5366
455 V C 0.0000
456 K C -2.6687
457 G C -2.0902
458 H C -1.9666
459 G C 0.0000
460 K C -3.6001
461 K C -3.1753
462 V C -1.6309
463 A C 0.0000
464 D C -3.0362
465 A C -1.7218
466 L C -1.1844
467 T C -1.6428
468 N C -1.7819
469 A C 0.0000
470 V C 0.0000
471 A C -1.4354
472 H C -2.2503
473 V C -1.9805
474 D C -2.9616
475 D C -3.2436
476 M C 0.0000
477 P C -1.7406
478 N C -2.1740
479 A C -1.6860
480 L C 0.0000
481 S C -0.6021
482 A C -0.1184
483 L C -0.0187
484 S C 0.0000
485 D C -1.0001
486 L C -0.3812
487 H C -0.6297
488 A C 0.0000
489 H C -1.8302
490 K C -1.8861
491 L C -0.4977
492 R C -0.9122
493 V C -0.0374
494 D C 0.0000
495 P C -0.2150
496 V C -0.0146
497 N C 0.0000
498 F C -0.2745
499 K C -1.2672
500 L C -0.1531
501 L C 0.1748
502 S C -0.3358
503 H C 0.0000
504 C C 0.0000
505 L C 0.0000
506 L C 0.0000
507 V C 0.0000
508 T C 0.0000
509 L C 0.0000
510 A C 0.0000
511 A C -1.0406
512 H C -1.1441
513 L C 0.0000
514 P C -0.5724
515 A C -0.3403
516 E C -0.7312
517 F C 0.0000
518 T C -0.1819
519 P C -0.2474
520 A C -0.2317
521 V C -0.0557
522 H C 0.0000
523 A C -0.0952
524 S C 0.0000
525 L C 0.0000
526 D C -0.3977
527 K C -0.0215
528 F C 0.0000
529 L C 0.0000
530 A C -0.1992
531 S C 0.2633
532 V C 0.0000
533 S C -0.2354
534 T C -0.1406
535 V C -0.2882
536 L C 0.0000
537 T C -0.3357
538 S C -0.4316
539 K C -0.8186
540 Y C 0.0000
541 R C -0.6485
544 V D 0.1311
545 H D -0.7601
546 L D -1.0546
547 T D -1.2783
548 P D -1.8689
549 E D -2.5342
550 E D -2.0689
551 K D -2.0701
552 S D -1.5286
553 A D -1.0088
554 V D 0.0000
555 T D -0.9165
556 A D -0.6582
557 L D 0.0000
558 W D -0.7022
559 G D -1.3145
560 K D -2.0009
561 V D -1.6873
562 N D -2.6559
563 V D -2.2535
564 D D -3.4740
565 E D -3.2430
566 V D 0.0000
567 G D 0.0000
568 G D 0.0000
569 E D -1.2179
570 A D 0.0000
571 L D 0.0000
572 G D 0.0000
573 R D 0.0000
574 L D 0.0000
575 L D 0.0000
576 V D -0.1193
577 V D 0.0000
578 Y D 0.0719
579 P D -0.4134
580 W D 0.0000
581 T D 0.0000
582 Q D -0.7758
583 R D -1.3659
584 F D -0.0512
585 F D -1.0215
586 E D -2.2246
587 S D -1.4377
588 F D -1.3464
589 G D -2.0091
590 D D -2.5827
591 L D 0.0000
592 S D -1.1415
593 T D -1.0547
594 P D -0.9402
595 D D -2.1060
596 A D -1.5848
597 V D 0.0000
598 M D -1.0548
599 G D -1.5490
600 N D -1.6014
601 P D -1.2108
602 K D -1.5811
603 V D 0.0000
604 K D -2.2795
605 A D -1.7893
606 H D -1.6703
607 G D 0.0000
608 K D -2.8039
609 K D -2.1817
610 V D -0.4161
611 L D 0.0000
612 G D -1.3516
613 A D -0.8754
614 F D 0.0000
615 S D -0.8746
616 D D -1.9141
617 G D 0.0000
618 L D -1.0599
619 A D -1.1647
620 H D -2.1265
621 L D -1.6576
622 D D -2.5728
623 N D -2.6384
624 L D 0.0000
625 K D -2.6893
626 G D -1.9216
627 T D -1.5429
628 F D 0.0000
629 A D -0.9837
630 T D -0.5035
631 L D -0.0080
632 S D 0.0000
633 E D -1.8904
634 L D -0.9276
635 H D -0.8986
636 C D 0.0000
637 D D -2.7336
638 K D -2.2835
639 L D -0.6813
640 H D -0.9133
641 V D -0.3025
642 D D 0.0000
643 P D -0.8067
644 E D -0.8753
645 N D -0.5589
646 F D -0.7472
647 R D -1.5362
648 L D -0.4771
649 L D -0.1718
650 G D 0.0000
651 N D -0.4645
652 V D 0.0000
653 L D 0.0000
654 V D 0.0000
655 C D 0.0000
656 V D 0.0000
657 L D 0.0000
658 A D 0.0000
659 H D -0.6820
660 H D -1.1422
661 F D -1.3168
662 G D -1.6097
663 K D -2.6166
664 E D -2.4511
665 F D 0.0000
666 T D -1.0058
667 P D -0.2532
668 P D -0.0973
669 V D -0.3121
670 Q D 0.0000
671 A D -0.0110
672 A D 0.0000
673 Y D 0.0000
674 Q D 0.0000
675 K D -0.5434
676 V D 0.0000
677 V D 0.0000
678 A D -0.6764
679 G D -0.7933
680 V D 0.0000
681 A D 0.0000
682 N D -1.9009
683 A D 0.0000
684 L D -1.0448
685 A D -1.6618
686 H D -2.2960
687 K D -2.3391
688 Y D -1.6218
689 H D -1.6630

 

Laboratory of Theory of Biopolymers 2015