Project name: 4mbe modifed

Status: done

submitted: 2018-12-10 13:01:45, status changed: 2018-12-10 13:20:42
Settings
Chain sequence(s) A: LNSELLEEQKQEIYEAFSLFDMNNDGFLDYHELKVAMKALGFELPKREILDLIDEYDSEGRHLMKYDDFYIVMGEKILKRDPLDEIKRAFQLFDDDHTGKISIKNLRRVAKELGETLTDEELRAMIEEFDLDGDGEINENEFIAICTDS
X: DKESIV
C: TMDTAQLKSQIQQYLVESGNYELISNELKARLLQEGWVDKVKDLTKSEMNINESTNFTQILSTVEPKALEMVSDSTRETVLKQIREFLEEIVDT
B: YRKDFIDTMTRELYDAFLHERLYLIYMDSRAELKRNSTLKKKFFEKWQAS
Distance of aggregation 10 Å
Dynamic mode No
Show buried residues

Minimal score value
-3.848
Maximal score value
1.1596
Average score
-1.3079
Total score value
-391.0498

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
13 L A -0.5122
14 N A -1.5459
15 S A -1.4734
16 E A -2.0155
17 L A 0.0000
18 L A -1.0116
19 E A -2.5664
20 E A -1.9985
21 Q A -1.3584
22 K A -1.6315
23 Q A -1.7495
24 E A 0.0000
25 I A 0.0000
26 Y A 0.5452
27 E A -0.3918
28 A A 0.0000
29 F A 0.0000
30 S A -0.2076
31 L A -0.0058
32 F A 0.0000
33 D A -1.0550
34 M A -0.4945
35 N A -2.0604
36 N A -2.4628
37 D A -2.6896
38 G A -1.6258
39 F A -1.0268
40 L A 0.0000
41 D A -1.2835
42 Y A -0.8903
43 H A -1.2315
44 E A -0.6518
45 L A 0.0000
46 K A -1.6903
47 V A 0.0000
48 A A 0.0000
49 M A 0.0000
50 K A -1.2673
51 A A 0.0000
52 L A 0.0000
53 G A -0.8662
54 F A -1.0118
55 E A -2.2591
56 L A -1.9257
57 P A -2.6099
58 K A -3.6099
59 R A -3.6681
60 E A -3.6173
61 I A 0.0000
62 L A -2.8360
63 D A -3.8289
64 L A -2.2820
65 I A 0.0000
66 D A -3.8480
67 E A -2.9700
68 Y A -1.8129
69 D A -2.8366
70 S A -2.1772
71 E A -3.0518
72 G A -2.7893
73 R A -3.3117
74 H A -2.2721
75 L A -1.4704
76 M A 0.0000
77 K A -1.2570
78 Y A -0.6817
79 D A -1.5960
80 D A -0.8042
81 F A 0.0000
82 Y A -0.0275
83 I A 0.2795
84 V A 0.0000
85 M A 0.0000
86 G A 0.0000
87 E A -1.4378
88 K A -1.2671
89 I A 0.0000
90 L A -1.2095
91 K A -2.4216
92 R A -2.3386
93 D A -2.8475
94 P A -1.8451
95 L A -1.4282
96 D A -2.8159
97 E A -1.9806
98 I A 0.0000
99 K A -2.3391
100 R A -1.8877
101 A A 0.0000
102 F A 0.0000
103 Q A -2.7129
104 L A -1.6283
105 F A 0.0000
106 D A 0.0000
107 D A -3.4223
108 D A -3.5970
109 H A -2.9247
110 T A -1.9431
111 G A -2.1254
112 K A -2.5897
113 I A 0.0000
114 S A 0.0000
115 I A -1.3624
116 K A -2.3646
117 N A 0.0000
118 L A 0.0000
119 R A -2.9937
120 R A -2.6544
121 V A 0.0000
122 A A 0.0000
123 K A -3.1008
124 E A -2.8997
125 L A -1.9560
126 G A -1.8604
127 E A -1.9751
128 T A -0.8506
129 L A -1.2948
130 T A -1.7486
131 D A -2.6092
132 E A -3.0879
133 E A -2.8452
134 L A 0.0000
135 R A -2.7941
136 A A -2.6271
137 M A 0.0000
138 I A 0.0000
139 E A -3.3267
140 E A -2.5107
141 F A -1.3400
142 D A -1.9383
143 L A -0.7416
144 D A -2.3245
145 G A -2.2457
146 D A -3.0062
147 G A -2.1236
148 E A -2.2010
149 I A 0.0000
150 N A -2.4321
151 E A -2.5037
152 N A -1.9250
153 E A 0.0000
154 F A 0.0000
155 I A -0.9049
156 A A -0.7674
157 I A 0.0000
158 C A 0.0000
159 T A -0.9443
160 D A -1.9934
161 S A -1.2123
756 Y B -0.1236
757 R B -1.5845
758 K B -2.4691
759 D B -2.2626
760 F B -1.3124
761 I B 0.0000
762 D B -2.5024
763 T B -2.1460
764 M B 0.0000
765 T B 0.0000
766 R B -3.3535
767 E B -3.3839
768 L B 0.0000
769 Y B 0.0000
770 D B -2.8565
771 A B -1.8378
772 F B 0.0000
773 L B 0.0000
774 H B -1.2526
775 E B -0.8778
776 R B -0.6099
777 L B 0.0000
778 Y B 0.2563
779 L B 0.2249
780 I B -0.0844
781 Y B 0.0000
782 M B 0.0000
783 D B -0.3733
784 S B 0.0000
785 R B 0.0000
786 A B 0.0000
787 E B -0.8305
788 L B -0.6363
789 K B -0.5946
790 R B -0.5955
791 N B -0.7969
792 S B -0.8237
793 T B 0.0000
794 L B 0.0000
795 K B 0.0000
796 K B -2.0976
797 K B -1.8385
798 F B 0.0000
799 F B 0.0000
800 E B -2.9902
801 K B -2.4772
802 W B 0.0000
803 Q B -1.8622
804 A B -1.2011
805 S B -1.4070
2 T C -1.4528
3 M C -1.9409
4 D C -2.8151
5 T C -1.9072
6 A C -1.2184
7 Q C -1.6954
8 L C 0.0000
9 K C -2.1152
10 S C -1.5450
11 Q C -1.1623
12 I C 0.0000
13 Q C -1.6823
14 Q C -1.6846
15 Y C -0.7915
16 L C 0.0000
17 V C -0.1846
18 E C -1.7534
19 S C -0.9855
20 G C -0.6012
21 N C -0.4268
22 Y C -0.3449
23 E C -1.2352
24 L C -0.3890
25 I C 0.0000
26 S C 0.0000
27 N C -2.0888
28 E C -2.4186
29 L C 0.0000
30 K C -1.4973
31 A C -1.3090
32 R C -1.6251
33 L C 0.0000
34 L C 0.0996
35 Q C -1.0499
36 E C -1.1612
37 G C -1.1573
38 W C 0.0000
39 V C -1.4646
40 D C -2.7891
41 K C -3.0023
42 V C 0.0000
43 K C -2.6628
44 D C -3.3012
45 L C -2.2976
46 T C 0.0000
47 K C -2.1675
48 S C -1.9228
49 E C -2.0344
50 M C 0.0000
51 N C -1.4885
52 I C -0.0944
53 N C -1.9392
54 E C -2.8449
55 S C -1.7520
56 T C -1.3621
57 N C -1.5166
58 F C -0.7421
59 T C -0.6105
60 Q C -1.2126
61 I C -0.6338
62 L C 0.0000
63 S C -0.8632
64 T C -0.9001
65 V C 0.0000
66 E C -1.3232
67 P C -1.5021
68 K C -2.3622
69 A C 0.0000
70 L C -1.6178
71 E C -2.5753
72 M C -1.5992
73 V C 0.0000
74 S C -1.8174
75 D C -2.8586
76 S C -1.9222
77 T C 0.0000
78 R C -2.5285
79 E C -3.0995
80 T C -2.2690
81 V C 0.0000
82 L C -2.4841
83 K C -3.2558
84 Q C -2.5472
85 I C 0.0000
86 R C -3.7468
87 E C -3.6541
88 F C 0.0000
89 L C 0.0000
90 E C -3.0723
91 E C -2.6598
92 I C -1.0155
93 V C 0.0000
94 D C -1.7505
95 T C -0.9733
325 D X -2.9536
326 K X -3.0215
327 E X -2.2161
328 S X -1.2198
329 I X 0.0000
330 V X 1.1596

 

Laboratory of Theory of Biopolymers 2015