Project name: MUT7

Status: done

Started: 2026-08-16 07:40:21
Chain sequence(s) A: QCISPGTGYNNGYFYSYWNDGRGGVTYCNGPGGQFSVNWSNSGNFVGGKGWQPGTKNKVINFSGSYNPNGNSYLSVYGWTRNPLIEYYIVENFGTYNPSTGATKLGEVTSDGSVYDIYQTQRVNQPSIIGTATFYQYWSVRRNHRSSGTVNTANHFNAWAQLGLTLGTMDYQIVAVEGYFSSGSADITVS
input PDB
Selected Chain(s) A
Distance of aggregation 10 Å
FoldX usage Yes
pH calculations No
alphaCutter usage No
Dynamic mode No
Automated mutations No
Downloads Download all the data
Simulation log 
[INFO]       Logger:   Verbosity set to: 2 - [INFO]                                                (00:00:02)
[WARNING]    runJob:   Working directory already exists (possibly overwriting previous results -ow 
                       to prevent this behavior)                                                   (00:00:02)
[INFO]       runJob:   Starting aggrescan3d job on: input.pdb with A chain(s) selected             (00:00:02)
[INFO]       runJob:   Creating pdb object from: input.pdb                                         (00:00:02)
[INFO]       FoldX:    Starting FoldX energy minimization                                          (00:00:02)
[INFO]       Analysis: Starting Aggrescan4D on folded.pdb                                          (00:02:38)
[INFO]       Main:     Simulation completed successfully.                                          (00:02:41)
Show buried residues
Minimal score value
-2.5152
Maximal score value
1.9471
Average score
-0.463
Total score value
-87.9712
Download the table (csv)

The table below lists A4D score for protein residues. Residues with A4D score > 0.0000 are marked by yellow rows.

residue index residue name chain Aggrescan4D score mutation
1 Q A -0.7447
2 C A 0.3687
3 I A 0.4018
4 S A 0.1077
5 P A -0.3024
6 G A -0.2413
7 T A 0.1232
8 G A 0.4482
9 Y A 0.8582
10 N A -0.4550
11 N A -1.3971
12 G A -0.7368
13 Y A -0.1805
14 F A 0.0000
15 Y A 0.2591
16 S A 0.0000
17 Y A 0.0000
18 W A -0.1628
19 N A -1.1492
20 D A -1.9702
21 G A -1.9532
22 R A -2.3820
23 G A -1.8800
24 G A -1.3060
25 V A -1.0387
26 T A -0.2877
27 Y A 0.0000
28 C A -0.1461
29 N A 0.0000
30 G A -0.8833
31 P A -1.0512
32 G A -1.0796
33 G A 0.0000
34 Q A -0.9188
35 F A 0.0000
36 S A -0.8037
37 V A 0.0000
38 N A -1.5520
39 W A 0.0000
40 S A -1.1626
41 N A -1.2257
42 S A 0.0000
43 G A 0.0000
44 N A -0.3022
45 F A 0.0000
46 V A 0.0000
47 G A 0.0000
48 G A 0.0000
49 K A 0.0000
50 G A 0.0000
51 W A 0.0366
52 Q A -0.2724
53 P A -0.4434
54 G A 0.0000
55 T A -1.0315
56 K A -1.8665
57 N A -2.0651
58 K A -1.1297
59 V A -0.1528
60 I A 0.0000
61 N A -0.8265
62 F A 0.0000
63 S A -0.7612
64 G A -0.7766
65 S A -0.9621
66 Y A -1.0917
67 N A -1.8671
68 P A -1.6027
69 N A -1.7473
70 G A -0.6642
71 N A 0.0473
72 S A 0.0000
73 Y A 0.0000
74 L A 0.0000
75 S A 0.0000
76 V A 0.0000
77 Y A 0.0000
78 G A 0.0000
79 W A 0.0000
80 T A 0.0000
81 R A -1.5896
82 N A -1.9358
83 P A -1.1757
84 L A -0.3529
85 I A 0.0000
86 E A 0.0000
87 Y A 0.0000
88 Y A 0.0000
89 I A 0.0000
90 V A 0.0000
91 E A 0.0000
92 N A -0.8761
93 F A -0.3826
94 G A -0.6989
95 T A -0.3211
96 Y A 0.2281
97 N A -0.3325
98 P A 0.0000
99 S A 0.0000
100 T A -0.5029
101 G A -0.7721
102 A A -0.7335
103 T A -0.8791
104 K A -1.6115
105 L A -0.4673
106 G A -1.0468
107 E A -1.6831
108 V A -0.8314
109 T A -0.4647
110 S A 0.0000
111 D A -0.8901
112 G A -0.8578
113 S A 0.0000
114 V A -0.8316
115 Y A 0.0000
116 D A 0.0000
117 I A 0.0000
118 Y A -0.6976
119 Q A -0.4681
120 T A -0.5636
121 Q A -0.7377
122 R A -0.7521
123 V A 0.3629
124 N A -1.1470
125 Q A -1.2363
126 P A -0.5332
127 S A 0.2915
128 I A 1.2865
129 I A 1.9471
130 G A 0.4432
131 T A -0.1711
132 A A -0.0506
133 T A -0.2786
134 F A 0.0000
135 Y A 0.2654
136 Q A 0.0000
137 Y A 0.0000
138 W A 0.0000
139 S A 0.0000
140 V A 0.0000
141 R A 0.0000
142 R A -2.5152
143 N A -2.4711
144 H A -1.7883
145 R A -1.1754
146 S A -0.7288
147 S A -0.6439
148 G A -0.6805
149 T A -0.5225
150 V A 0.0000
151 N A -0.8375
152 T A 0.0000
153 A A 0.0000
154 N A -1.3677
155 H A 0.0000
156 F A 0.0000
157 N A -1.9397
158 A A -1.3365
159 W A 0.0000
160 A A -0.9171
161 Q A -1.3568
162 L A -0.3964
163 G A -0.5833
164 L A 0.0000
165 T A -0.5039
166 L A -0.6351
167 G A -1.0429
168 T A -0.9479
169 M A -0.7143
170 D A 0.0000
171 Y A 0.0000
172 Q A 0.0000
173 I A 0.0000
174 V A 0.0000
175 A A 0.0000
176 V A 0.0000
177 E A -0.0308
178 G A 0.0000
179 Y A 1.2830
180 F A 1.4628
181 S A 0.0000
182 S A -1.0547
183 G A -1.5768
184 S A -1.4320
185 A A 0.0000
186 D A -1.3590
187 I A 0.0000
188 T A -0.7642
189 V A 0.0000
190 S A -0.4236
Download PDB file
View in 3Dmol