Project name: a49ec8a6e5486d1 [mutate: YB27L, FB26A, YB59A, VB14A, LB8A]

Status: done

submitted: 2018-08-15 16:11:52, status changed: 2018-08-15 16:21:42
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Chain sequence(s) A: MKSNEHDDCQVTNPSTGHLFDLSSLSGRAGFTAAYSKSGVVYMSICGENENCPPGVGACFGQTRISVGKANKRLRYVDQVLQLVYKDGSPCPSKSGLSYKSVISFVCRPEAGPTNRPMLISLDKQTCTLFFSWHTPLACEPE
B: AYRPSETLCGGELVDTLQFVCGDRGFYFSRPASRVSRRSRGIVEECCFRSCDLALLETYCATPAKSE
Distance of aggregation 10 Å
Dynamic mode No
Mutated residues YB27L, FB26A, YB59A, VB14A, LB8A
Energy difference between WT (input) and mutated protein (by FoldX) 4.76355 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
-4.2612
Maximal score value
2.5009
Average score
-0.8925
Total score value
-186.5304

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
1508 M A 0.0798
1509 K A -1.6663
1510 S A -1.6515
1511 N A -1.7378
1512 E A -3.5897
1513 H A -3.6822
1514 D A -4.2612
1515 D A -3.7836
1516 C A 0.0000
1517 Q A -2.2220
1518 V A 0.0000
1519 T A -0.6443
1520 N A 0.0000
1521 P A -0.5233
1522 S A -0.5468
1523 T A -0.6827
1524 G A -0.5119
1525 H A -0.0945
1526 L A 0.6367
1527 F A 0.0000
1528 D A -0.5153
1529 L A 0.0000
1530 S A -0.8415
1531 S A -0.3118
1532 L A 0.0083
1533 S A -0.7928
1534 G A -1.5483
1535 R A -2.9506
1536 A A -1.6808
1537 G A -1.0717
1538 F A 0.0733
1539 T A 0.2399
1540 A A 0.2706
1541 A A 0.2728
1542 Y A 0.4025
1543 S A -0.8710
1544 K A -2.0765
1545 S A -1.2545
1546 G A 0.0000
1547 V A 0.5541
1548 V A 0.0000
1549 Y A -0.5273
1550 M A 0.0000
1551 S A 0.0000
1552 I A 0.0000
1553 C A -1.8341
1554 G A -1.9696
1555 E A -3.1492
1556 N A 0.0000
1557 E A -3.2313
1558 N A -2.3660
1559 C A 0.0000
1560 P A -1.4721
1561 P A -1.4460
1562 G A -1.4666
1563 V A 0.0000
1564 G A 0.0000
1565 A A 0.0000
1566 C A 0.0000
1567 F A 0.0000
1568 G A -0.5976
1569 Q A -0.7281
1570 T A -0.9357
1571 R A -1.5467
1572 I A -0.7055
1573 S A -0.9770
1574 V A 0.0000
1575 G A 0.0000
1576 K A -2.3109
1577 A A -1.9075
1578 N A -2.3456
1579 K A -3.0942
1580 R A -3.8192
1581 L A 0.0000
1582 R A -2.2883
1583 Y A -0.7995
1584 V A 0.0271
1585 D A -1.5215
1586 Q A -1.0203
1587 V A -0.1792
1588 L A 0.0000
1589 Q A -0.7106
1590 L A 0.0000
1591 V A -1.0445
1592 Y A 0.0000
1593 K A -2.2536
1594 D A -2.1018
1595 G A -1.5048
1596 S A -0.9687
1597 P A -1.1012
1598 C A 0.0000
1599 P A -1.3616
1600 S A 0.0000
1601 K A -2.4345
1602 S A -1.7866
1603 G A -1.1408
1604 L A -0.8815
1605 S A -1.0615
1606 Y A 0.0000
1607 K A -1.2125
1608 S A 0.0000
1609 V A 0.4271
1610 I A 0.0000
1611 S A 0.5546
1612 F A 0.0000
1613 V A 0.0441
1614 C A -0.3193
1615 R A -1.3584
1616 P A -1.4494
1617 E A -2.2836
1618 A A -1.5554
1619 G A -1.5324
1620 P A -1.0114
1621 T A -1.1951
1622 N A -1.7555
1623 R A -2.0344
1624 P A 0.0000
1625 M A 0.6253
1626 L A 1.7206
1627 I A 2.5009
1628 S A 1.0043
1629 L A -0.1119
1630 D A -1.3602
1631 K A -2.3844
1632 Q A -2.3173
1633 T A -1.5231
1634 C A 0.0000
1635 T A 0.0000
1636 L A 0.0000
1637 F A 1.4961
1638 F A 0.0000
1639 S A 0.5823
1640 W A 0.0000
1641 H A -1.0265
1642 T A 0.0000
1643 P A -0.6666
1644 L A 0.3452
1645 A A 0.0000
1646 C A -0.1855
1647 E A 0.0000
1648 P A -1.2095
1649 E A -1.9444
1 A B 0.2754
2 Y B 0.1260
3 R B -1.7579
4 P B -1.3315
5 S B -1.2594
6 E B -2.3164
7 T B -1.1804
8 A B -0.5178 mutated: LB8A
9 C B 0.0099
10 G B -0.1834
11 G B -0.5293
12 E B -0.8428
13 L B 0.0000
14 A B -0.0787 mutated: VB14A
15 D B 0.0000
16 T B -0.1925
17 L B 0.0000
18 Q B -1.1363
19 F B -0.2768
20 V B -0.2281
21 C B 0.0000
22 G B -2.0797
23 D B -3.0492
24 R B -2.6031
25 G B -1.1839
26 A B -0.0707 mutated: FB26A
27 L B 0.8779 mutated: YB27L
28 F B 0.0742
29 S B -0.7710
30 R B -1.7476
31 P B -1.6087
32 A B -1.7088
33 S B -1.4600
34 R B -1.6026
35 V B -0.0290
36 S B -1.3521
37 R B -2.5450
38 R B -3.2832
39 S B -2.6115
40 R B -2.6554
41 G B -1.5436
42 I B 0.0000
43 V B -0.9997
44 E B -2.3510
45 E B -2.3904
46 C B 0.0000
47 C B -0.7323
48 F B 0.0120
49 R B -1.9926
50 S B -1.8697
51 C B -1.5902
52 D B -2.1033
53 L B -1.3906
54 A B -0.8023
55 L B 0.0025
56 L B 0.0000
57 E B -0.3555
58 T B -0.1196
59 A B 0.2208 mutated: YB59A
60 C B 0.0235
61 A B -0.2296
62 T B -0.8110
63 P B -1.0531
64 A B -1.5248
65 K B -2.6758
66 S B -2.2289
67 E B -2.5213

 

Laboratory of Theory of Biopolymers 2015