Project name: 5B6M peroxiredoxin 6

Status: done

submitted: 2018-11-15 14:51:23, status changed: 2018-11-15 15:34:32
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Chain sequence(s) A: GLLLGDVAPNFEANTTVGRIRFHDFLGDSWGILFSHPRDFTPVCTTELGRAAKLAPEFAKRNVKLIALSIDSVEDHLAWSKDINAYNCEEPTEKLPFPIIDDRNRELAILLGMLDPAEKDEKGMPVTARVVFVFGPDKKLKLSILYPATTGRNFDEILRVVISLQLTAEKRVATPVDWKDGDSVMVLPTIPEEEAKKLFPKGVFTKELPSGKKYLRYTPQP
C: GLLLGDVAPNFEANTTVGRIRFHDFLGDSWGILFSHPRDFTPVCTTELGRAAKLAPEFAKRNVKLIALSIDSVEDHLAWSKDINAYNCEEPTEKLPFPIIDDRNRELAILLGMLDPAEKDEKGMPVTARVVFVFGPDKKLKLSILYPATTGRNFDEILRVVISLQLTAEKRVATPVDWKDGDSVMVLPTIPEEEAKKLFPKGVFTKELRYTPQP
B: GLLLGDVAPNFEANTTVGRIRFHDFLGDSWGILFSHPRDFTPVCTTELGRAAKLAPEFAKRNVKLIALSIDSVEDHLAWSKDINAYNCEEPTEKLPFPIIDDRNRELAILLGMLDPAEKDEKGMPVTARVVFVFGPDKKLKLSILYPATTGRNFDEILRVVISLQLTAEKRVATPVDWKDGDSVMVLPTIPEEEAKKLFPKGVFTKELPSGKKYLRYTPQP
E: GLLLGDVAPNFEANTTVGRIRFHDFLGDSWGILFSHPRDFTPVCTTELGRAAKLAPEFAKRNVKLIALSIDSVEDHLAWSKDINAYNCEEPTEKLPFPIIDDRNRELAILLGMLDPAEKDEKGMPVTARVVFVFGPDKKLKLSILYPATTGRNFDEILRVVISLQLTAEKRVATPVDWKDGDSVMVLPTIPEEEAKKLFPKGVFTKELPSGKKYLRYTPQP
D: LLGDVAPNFEANTTVGRIRFHDFLGDSWGILFSHDFTPVCTTELGRAAKLAPEFAKRNVKLIALSIDSVEDHLAWSKDINAYNKLPFPIIDDRNRELAILLGMLDPAEKDEKGMPVTARVVFVFGPDKKLKLSILYPATTGRNFDEILRVVISLQLTAEKRVATPVDWKDGDSVMVLPTIPEEEAKKLFPKGVFTKELPSGKKYLRYTPQP
F: PGGLLLGDVAPNFEANTTVGRIRFHDFLGDSWGILFSHPRDFTPVCTTELGRAAKLAPEFAKRNVKLIALSIDSVEDHLAWSKDINAYNCEEPTEKLPFPIIDDRNRELAILLGMLDPAEKDEKGMPVTARVVFVFGPDKKLKLSILYPATTGRNFDEILRVVISLQLTAEKRVATPVDWKDGDSVMVLPTIPEEEAKKLFPKGVFTKELPSGKKYLRYTPQP
Distance of aggregation 10 Å
Dynamic mode No
Show buried residues

Minimal score value
-4.3799
Maximal score value
2.5487
Average score
-0.8395
Total score value
-1100.6078

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
4 G A 0.4480
5 L A 0.4766
6 L A 0.2328
7 L A 0.0000
8 G A -0.7060
9 D A -0.3475
10 V A 0.3011
11 A A 0.0000
12 P A -0.4005
13 N A -1.3242
14 F A -1.6990
15 E A -2.8652
16 A A -2.0655
17 N A -1.4362
18 T A 0.0000
19 T A -0.3299
20 V A 1.1862
21 G A -0.1788
22 R A -2.1017
23 I A -1.5986
24 R A -2.8096
25 F A 0.0000
26 H A -2.2335
27 D A -2.6512
28 F A -1.3432
29 L A 0.0000
30 G A -2.2133
31 D A -2.7686
32 S A 0.0000
33 W A -1.4651
34 G A 0.0000
35 I A 0.0000
36 L A 0.0000
37 F A 0.0000
38 S A 0.0000
39 H A 0.0000
40 P A 0.0000
41 R A -0.6915
42 D A 0.0000
43 F A -0.4155
44 T A -0.3235
45 P A 0.0000
46 V A 0.0000
47 C A 0.0000
48 T A 0.0000
49 T A 0.0000
50 E A 0.0000
51 L A 0.0000
52 G A 0.0000
53 R A -1.6464
54 A A 0.0000
55 A A -1.1290
56 K A -1.9295
57 L A -1.3177
58 A A 0.0000
59 P A -1.5396
60 E A -1.7763
61 F A 0.0000
62 A A -1.8485
63 K A -2.6409
64 R A -2.0737
65 N A -2.5003
66 V A 0.0000
67 K A -1.4715
68 L A 0.0000
69 I A 0.0000
70 A A 0.0000
71 L A 0.0000
72 S A 0.0000
73 I A 0.0000
74 D A 0.0000
75 S A -1.5306
76 V A -1.0371
77 E A -2.1758
78 D A -1.5011
79 H A 0.0000
80 L A -1.2629
81 A A -1.2825
82 W A 0.0000
83 S A 0.0000
84 K A -2.0465
85 D A 0.0000
86 I A 0.0000
87 N A -2.1303
88 A A -1.3888
89 Y A -0.8817
90 N A -1.1180
91 C A -0.7545
92 E A -2.5928
93 E A -3.1752
94 P A -2.3694
95 T A -2.3579
96 E A -2.9163
97 K A -2.4663
98 L A -1.0775
99 P A -0.7611
100 F A 0.0000
101 P A 0.0000
102 I A 0.0000
103 I A 0.0000
104 D A -1.7042
105 D A 0.0000
106 R A -2.7987
107 N A -2.5090
108 R A 0.0000
109 E A -1.6123
110 L A 0.0000
111 A A 0.0000
112 I A 1.8025
113 L A 1.4786
114 L A 0.0000
115 G A 1.0329
116 M A 0.0000
117 L A 0.5963
118 D A 0.0000
119 P A -0.7806
120 A A -0.8368
121 E A -1.6463
122 K A -2.6844
123 D A -2.4992
124 E A -3.0593
125 K A -2.8915
126 G A -2.1126
127 M A -1.2441
128 P A -1.2761
129 V A 0.0000
130 T A 0.0000
131 A A 0.0000
132 R A 0.0000
133 V A 0.0000
134 V A 0.0000
135 F A 0.0000
136 V A 0.0000
137 F A 0.0000
138 G A 0.0000
139 P A -2.1173
140 D A -2.4646
141 K A -1.7354
142 K A -1.6952
143 L A 0.0000
144 K A -1.0417
145 L A 0.0000
146 S A 0.0000
147 I A 0.0000
148 L A 0.2699
149 Y A 0.0000
150 P A 0.0000
151 A A -0.2110
152 T A -0.3325
153 T A 0.0000
154 G A 0.0000
155 R A 0.0000
156 N A -1.0604
157 F A 0.0000
158 D A -1.8942
159 E A 0.0000
160 I A 0.0000
161 L A -0.7202
162 R A 0.0000
163 V A 0.0000
164 V A 0.0000
165 I A -0.3628
166 S A 0.0000
167 L A 0.0000
168 Q A -0.6458
169 L A -1.1653
170 T A 0.0000
171 A A -1.3029
172 E A -2.4718
173 K A -2.2713
174 R A -1.8018
175 V A 0.0000
176 A A 0.0000
177 T A 0.0000
178 P A 0.0000
179 V A -0.5636
180 D A -1.4326
181 W A 0.0000
182 K A -3.2237
183 D A -3.3498
184 G A -2.7602
185 D A -3.1321
186 S A -1.6419
187 V A 0.0000
188 M A 0.0000
189 V A 0.0000
190 L A -0.1992
191 P A -0.5472
192 T A -0.4250
193 I A 0.0000
194 P A -2.3178
195 E A -3.7971
196 E A -4.0813
197 E A -3.5803
198 A A 0.0000
199 K A -3.6470
200 K A -3.4996
201 L A -2.0494
202 F A 0.0000
203 P A -1.5617
204 K A -1.7036
205 G A -0.7070
206 V A 0.1976
207 F A 1.4379
208 T A -0.3920
209 K A -1.4603
210 E A -2.6502
211 L A 0.0000
212 P A -1.1133
213 S A -1.4099
214 G A -2.2063
215 K A -2.8533
216 K A -2.8533
217 Y A 0.0000
218 L A 0.0000
219 R A 0.0000
220 Y A 0.6080
221 T A 0.0000
222 P A -0.9541
223 Q A -1.7616
224 P A -1.3509
4 G B 0.3712
5 L B 0.4406
6 L B 0.4319
7 L B 0.0000
8 G B -0.4635
9 D B -0.1239
10 V B 0.6017
11 A B 0.0000
12 P B -0.3209
13 N B -1.2710
14 F B -1.5998
15 E B -2.3840
16 A B 0.0000
17 N B -1.0055
18 T B 0.0000
19 T B -0.1601
20 V B 1.3205
21 G B 0.2928
22 R B -0.9554
23 I B -1.2197
24 R B -2.4241
25 F B 0.0000
26 H B -2.1851
27 D B -2.3987
28 F B -1.2248
29 L B 0.0000
30 G B -2.0275
31 D B -2.8123
32 S B 0.0000
33 W B -1.4347
34 G B 0.0000
35 I B 0.0000
36 L B 0.0000
37 F B 0.0000
38 S B 0.0000
39 H B 0.0000
40 P B 0.0000
41 R B -0.9212
42 D B 0.0000
43 F B -0.4063
44 T B -0.3716
45 P B 0.0000
46 V B 0.0000
47 C B 0.0000
48 T B 0.0000
49 T B 0.0000
50 E B 0.0000
51 L B 0.0000
52 G B 0.0000
53 R B -1.6946
54 A B 0.0000
55 A B -1.1013
56 K B -2.0106
57 L B -1.2767
58 A B 0.0000
59 P B -1.4476
60 E B -1.5971
61 F B 0.0000
62 A B -1.8341
63 K B -2.6208
64 R B -2.1628
65 N B -2.5019
66 V B 0.0000
67 K B -1.3620
68 L B 0.0000
69 I B 0.0000
70 A B 0.0000
71 L B 0.0000
72 S B 0.0000
73 I B 0.0000
74 D B 0.0000
75 S B -1.6322
76 V B 0.0000
77 E B -2.0941
78 D B -1.4235
79 H B 0.0000
80 L B 0.0000
81 A B -1.2405
82 W B 0.0000
83 S B 0.0000
84 K B -1.9768
85 D B 0.0000
86 I B 0.0000
87 N B 0.0000
88 A B -1.1470
89 Y B -0.5885
90 N B -1.0234
91 C B -0.5785
92 E B -2.4661
93 E B -3.0498
94 P B -2.2171
95 T B -2.2062
96 E B -2.4043
97 K B -2.3333
98 L B -1.0471
99 P B -0.8241
100 F B 0.0000
101 P B 0.0000
102 I B 0.0000
103 I B 0.0000
104 D B -1.5636
105 D B 0.0000
106 R B -2.8349
107 N B -2.3491
108 R B 0.0000
109 E B -1.7637
110 L B 0.0000
111 A B 0.0000
112 I B 1.7180
113 L B 1.2454
114 L B 0.0000
115 G B 0.7972
116 M B 0.0000
117 L B 0.6366
118 D B 0.0000
119 P B -0.7735
120 A B -0.7245
121 E B -1.5309
122 K B -2.6846
123 D B -2.6376
124 E B -3.1337
125 K B -2.9739
126 G B -2.1973
127 M B -1.2347
128 P B -1.2525
129 V B 0.0000
130 T B 0.0000
131 A B 0.0000
132 R B 0.0000
133 V B 0.0000
134 V B 0.0000
135 F B 0.0000
136 V B 0.0000
137 F B 0.0000
138 G B 0.0000
139 P B -2.0719
140 D B -2.3808
141 K B -1.5452
142 K B -1.1914
143 L B 0.0000
144 K B -0.8164
145 L B 0.0000
146 S B 0.0000
147 I B 0.0000
148 L B 0.1762
149 Y B 0.0000
150 P B 0.0000
151 A B -0.2284
152 T B -0.1618
153 T B 0.0000
154 G B 0.0000
155 R B 0.0000
156 N B -1.0568
157 F B 0.0000
158 D B -1.8862
159 E B 0.0000
160 I B 0.0000
161 L B -0.6345
162 R B 0.0000
163 V B 0.0000
164 V B 0.0000
165 I B -0.4542
166 S B 0.0000
167 L B 0.0000
168 Q B -0.7070
169 L B 0.0000
170 T B -1.3704
171 A B -1.5372
172 E B -2.6805
173 K B -2.6213
174 R B -2.5486
175 V B 0.0000
176 A B 0.0000
177 T B 0.0000
178 P B -0.3117
179 V B -0.5783
180 D B -1.4015
181 W B 0.0000
182 K B -3.0892
183 D B -3.1843
184 G B -2.4627
185 D B -2.5986
186 S B -1.3729
187 V B 0.0000
188 M B 0.0000
189 V B 0.0000
190 L B -0.3625
191 P B -0.6544
192 T B -0.4667
193 I B 0.0000
194 P B -2.6347
195 E B -4.0585
196 E B -4.2070
197 E B -3.6992
198 A B 0.0000
199 K B -3.9450
200 K B -3.6928
201 L B -2.3594
202 F B 0.0000
203 P B -1.8601
204 K B -2.0787
205 G B -0.9566
206 V B -0.0130
207 F B 1.2059
208 T B -0.3005
209 K B -1.5522
210 E B -2.6523
211 L B 0.0000
212 P B -0.9867
213 S B -1.2286
214 G B -1.8488
215 K B -2.6233
216 K B -2.9462
217 Y B 0.0000
218 L B 0.0000
219 R B 0.0000
220 Y B 0.9233
221 T B 0.0000
222 P B -0.7894
223 Q B -1.4399
224 P B -1.2839
4 G C 0.3634
5 L C 0.3448
6 L C 0.1522
7 L C 0.0000
8 G C -0.6812
9 D C -0.4907
10 V C 0.3415
11 A C 0.0000
12 P C -0.5067
13 N C -1.6625
14 F C 0.0000
15 E C -2.5920
16 A C 0.0000
17 N C -1.3313
18 T C 0.0000
19 T C -0.3150
20 V C 1.0281
21 G C -0.4374
22 R C -2.2441
23 I C -2.1162
24 R C -3.1166
25 F C 0.0000
26 H C -2.2823
27 D C -2.7056
28 F C -1.6666
29 L C 0.0000
30 G C -2.0231
31 D C -2.4591
32 S C -1.4733
33 W C -0.8390
34 G C 0.0000
35 I C 0.0000
36 L C 0.0000
37 F C 0.0000
38 S C 0.0000
39 H C 0.0000
40 P C 0.0000
41 R C -0.6816
42 D C 0.0000
43 F C -0.4437
44 T C -0.3703
45 P C 0.0000
46 V C 0.0000
47 C C 0.0000
48 T C 0.0000
49 T C 0.0000
50 E C 0.0000
51 L C 0.0000
52 G C 0.0000
53 R C -1.4940
54 A C 0.0000
55 A C -1.0233
56 K C -1.8103
57 L C -1.2409
58 A C 0.0000
59 P C -0.8252
60 E C -1.1073
61 F C 0.0000
62 A C 0.0000
63 K C -1.2725
64 R C -1.1321
65 N C -1.3021
66 V C 0.0000
67 K C -0.4895
68 L C 0.0000
69 I C 0.0000
70 A C 0.0000
71 L C 0.0000
72 S C 0.0000
73 I C 0.0000
74 D C 0.0000
75 S C -1.3705
76 V C -0.9791
77 E C -2.1479
78 D C -1.4875
79 H C 0.0000
80 L C -1.3044
81 A C -1.3910
82 W C 0.0000
83 S C 0.0000
84 K C -2.3932
85 D C 0.0000
86 I C 0.0000
87 N C -2.0717
88 A C -1.4589
89 Y C -0.6948
90 N C -1.0702
91 C C -0.5665
92 E C -2.5641
93 E C -3.1750
94 P C -2.4390
95 T C -2.4243
96 E C -2.8075
97 K C -2.4151
98 L C -1.0346
99 P C -0.6923
100 F C 0.0000
101 P C 0.0000
102 I C 0.0000
103 I C 0.0000
104 D C 0.0000
105 D C 0.0000
106 R C -2.5941
107 N C -2.5320
108 R C -1.4564
109 E C -1.7332
110 L C 0.0000
111 A C 0.0000
112 I C 1.5517
113 L C 1.1186
114 L C 0.0000
115 G C 0.9829
116 M C 0.0000
117 L C 0.7358
118 D C 0.0000
119 P C -0.7011
120 A C -0.9216
121 E C -2.0450
122 K C -2.7481
123 D C -2.5781
124 E C -3.1940
125 K C -2.9559
126 G C -2.2582
127 M C -1.3197
128 P C -1.3499
129 V C 0.0000
130 T C 0.0000
131 A C 0.0000
132 R C 0.0000
133 V C 0.0000
134 V C 0.0000
135 F C 0.0000
136 V C 0.0000
137 F C 0.0000
138 G C 0.0000
139 P C -1.5957
140 D C -2.2196
141 K C -1.5384
142 K C -1.2938
143 L C 0.0000
144 K C -0.9194
145 L C 0.0000
146 S C 0.0315
147 I C 0.0000
148 L C 0.3542
149 Y C 0.0000
150 P C -0.2598
151 A C 0.0000
152 T C -0.3867
153 T C 0.0000
154 G C 0.0000
155 R C 0.0000
156 N C -0.9203
157 F C 0.0000
158 D C -1.9164
159 E C 0.0000
160 I C 0.0000
161 L C -0.7727
162 R C -1.3338
163 V C 0.0000
164 V C 0.0000
165 I C -0.3412
166 S C 0.0000
167 L C 0.0000
168 Q C -0.6456
169 L C -1.3009
170 T C -1.3596
171 A C -1.5792
172 E C -2.6323
173 K C -2.7099
174 R C -2.3686
175 V C 0.0000
176 A C 0.0000
177 T C 0.0000
178 P C -0.5689
179 V C -0.9637
180 D C -1.8874
181 W C 0.0000
182 K C -3.1646
183 D C -3.0781
184 G C -2.3293
185 D C -2.1668
186 S C -1.1712
187 V C 0.0000
188 M C 0.0000
189 V C 0.0000
190 L C -0.3058
191 P C 0.1704
192 T C -0.2122
193 I C -1.0787
194 P C -2.0274
195 E C -3.5437
196 E C -3.6930
197 E C -3.0299
198 A C 0.0000
199 K C -3.4735
200 K C -2.9603
201 L C -1.1205
202 F C -1.3695
203 P C -1.4131
204 K C -2.0820
205 G C -1.3931
206 V C 0.4100
207 F C 1.6401
208 T C -0.2385
209 K C -1.9688
210 E C -1.9923
211 L C -0.0222
219 R C 0.2177
220 Y C 0.8596
221 T C 0.0000
222 P C -0.6406
223 Q C -1.4923
224 P C -1.1650
6 L D 1.0173
7 L D 0.0000
8 G D -1.0306
9 D D -1.2118
10 V D -0.3817
11 A D -0.5839
12 P D -0.8431
13 N D -1.8677
14 F D -2.0020
15 E D -2.8932
16 A D -2.1957
17 N D -1.6035
18 T D 0.0000
19 T D 0.2611
20 V D 0.9115
21 G D -0.8566
22 R D -2.4381
23 I D 0.0000
24 R D -2.7397
25 F D -1.6291
26 H D -1.9819
27 D D -1.6111
28 F D -0.2229
29 L D -0.0457
30 G D -1.4406
31 D D -2.6267
32 S D -1.6893
33 W D 0.0000
34 G D -0.5072
35 I D 0.0000
36 L D 0.0000
37 F D 0.0000
38 S D 0.0000
39 H D 0.0000
42 D D 0.1778
43 F D 1.6768
44 T D 0.7058
45 P D 0.1741
46 V D 0.0000
47 C D 0.0000
48 T D 0.0926
49 T D -0.2006
50 E D 0.0000
51 L D 0.0000
52 G D -1.0468
53 R D -1.5565
54 A D 0.0000
55 A D -1.3985
56 K D -2.2812
57 L D -1.2094
58 A D -1.1180
59 P D -1.4147
60 E D -1.7889
61 F D 0.0000
62 A D -1.8443
63 K D -2.6386
64 R D -2.1904
65 N D -2.2881
66 V D 0.0000
67 K D -1.0434
68 L D 0.0000
69 I D 0.0000
70 A D 0.0000
71 L D 0.0000
72 S D 0.0000
73 I D -0.6119
74 D D -1.5177
75 S D -1.6129
76 V D 0.0000
77 E D -2.5073
78 D D -2.3960
79 H D 0.0000
80 L D -0.6883
81 A D -0.7921
82 W D 0.0000
83 S D 0.0000
84 K D -1.8943
85 D D -1.6707
86 I D 0.0000
87 N D -2.3912
88 A D -1.1413
89 Y D -0.1245
90 N D -1.3588
97 K D -1.9840
98 L D -1.0157
99 P D -0.7875
100 F D 0.0000
101 P D 0.1321
102 I D 0.0000
103 I D 0.0000
104 D D 0.0000
105 D D 0.0000
106 R D -1.2146
107 N D -1.4785
108 R D -1.0511
109 E D -1.3319
110 L D 0.1779
111 A D 1.0417
112 I D 2.5487
113 L D 2.3801
114 L D 1.7593
115 G D 1.5474
116 M D 0.0000
117 L D 1.3571
118 D D 0.0000
119 P D -0.7686
120 A D -1.0770
121 E D -2.3158
122 K D -3.6080
123 D D -4.1327
124 E D -3.9082
125 K D -3.3459
126 G D -2.2889
127 M D -1.0697
128 P D -0.9876
129 V D 0.0000
130 T D -0.0885
131 A D 0.0000
132 R D 0.0000
133 V D 0.0000
134 V D 0.0000
135 F D 0.2244
136 V D 0.0000
137 F D -1.0764
138 G D 0.0000
139 P D -2.2652
140 D D -2.8326
141 K D -2.7761
142 K D -1.9161
143 L D 0.0000
144 K D -0.9430
145 L D 0.0000
146 S D 0.3151
147 I D 0.0000
148 L D 0.1605
149 Y D 0.0000
150 P D 0.0000
151 A D 0.0000
152 T D -0.2584
153 T D 0.0000
154 G D 0.0000
155 R D 0.0000
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224 P F -1.3173

 

Laboratory of Theory of Biopolymers 2015