Metelimumab / 6anp

A4DAB169_6anp_B_A | Source PDB: 6anp | Chains: B, A | Done
99.13
Yes
10 Å
Yes
Avg A4D Score
-0.7066
Max Score
1.3381
Min Score
-3.5839
Total Score
-298.9
Score CDR
-0.4942
Score non-CDR
-0.7624

Calculation Parameters

Chain Sequence(s) QLVESGGGVVQPGRSLRLSCAASGFTFSSYGMHWVRQAPGKELEWVAVISYDGSIKYYADSVKGRFTISRDNSKNTLYLQMNSLRAEDTAVYYCARTGEYSSWGQGTTVTVGGSTKGPSVFPLAPCSESTAALGCLVKDYFPEPVTVSWNSGALTSGVHTFPAVLQSSGLYSLSSVVTVPSSSLGTKTYTCNVDHKPSNTKVDKRVHHHEIVLTQSPSSLSASVGDRVTITCRASQGIGDDLGWYQQKPGKAPILLIYGTSTLQSGVPSRFSGSGSGTDFTLTINSLQPEDFATYYCLQDSNYPLTFGGGTRLEIKRTVAAPSVFIFPPSDEQLKSGTASVVCLLNNFYPREAKVQWKVDNALQSGNSQESVTEQDSKDSTYSLSSTLTLSKADYEKHKVYACEVTHQGLSSPVTKSFNRGEC input.pdb
Selected Chain(s) B (Heavy), A (Light)
Distance of Aggregation 10 Å
FoldX Energy Minimization Yes
pH Calculations Yes
Downloads Download all data (.tar.gz)

Aggrescan4D Profile

Aggregation-prone (score > 0)
Soluble (score < 0)
Buried (score = 0)

Per-Residue A4D Scores

Download CSV
Minimum Score -3.5839
Maximum Score 1.3381
Average Score -0.7066
Total Score -298.8965

Residues with A4D score > 0.0 are highlighted as aggregation-prone.

Index Residue Chain A4D Score Classification
3 Q B -1.3006 Soluble
4 L B 0.0000 Buried
5 V B 0.1875 Aggregation-prone
6 E B 0.0000 Buried
7 S B -0.5440 Soluble
8 G B -0.9145 Soluble
9 G B -0.4286 Soluble
11 G B 0.2888 Aggregation-prone
12 V B 0.7675 Aggregation-prone
13 V B 0.0000 Buried
14 Q B -1.8007 Soluble
15 P B -2.0365 Soluble
16 G B -2.0493 Soluble
17 R B -2.7288 Soluble
18 S B -1.8840 Soluble
19 L B -1.2262 Soluble
20 R B -1.7594 Soluble
21 L B 0.0000 Buried
22 S B -0.4510 Soluble
23 C B 0.0000 Buried
24 A B -0.3118 Soluble
25 A B -0.7193 Soluble
26 S B -0.7735 Soluble
27 G B -0.6531 Soluble
28 F B -0.1452 Soluble
29 T B -0.0216 Soluble
30 F B 0.0000 Buried
35 S B -0.6627 Soluble
36 S B -0.1838 Soluble
37 Y B -0.1423 Soluble
38 G B -0.1728 Soluble
39 M B 0.0000 Buried
40 H B -0.1970 Soluble
41 W B 0.0000 Buried
42 V B 0.0000 Buried
43 R B 0.0000 Buried
44 Q B -1.0665 Soluble
45 A B -1.3992 Soluble
46 P B -1.0797 Soluble
47 G B -1.6304 Soluble
48 K B -2.6638 Soluble
49 E B -2.2197 Soluble
50 L B 0.0000 Buried
51 E B -1.2596 Soluble
52 W B 0.0000 Buried
53 V B 0.0000 Buried
54 A B 0.0000 Buried
55 V B 0.0000 Buried
56 I B 0.0000 Buried
57 S B 0.3168 Aggregation-prone
58 Y B 0.3438 Aggregation-prone
59 D B -1.2116 Soluble
62 G B -0.5609 Soluble
63 S B -0.0328 Soluble
64 I B 1.0605 Aggregation-prone
65 K B 0.3921 Aggregation-prone
66 Y B 0.6177 Aggregation-prone
67 Y B -0.5148 Soluble
68 A B 0.0000 Buried
69 D B -2.5443 Soluble
70 S B -1.9065 Soluble
71 V B 0.0000 Buried
72 K B -2.5486 Soluble
74 G B -1.7996 Soluble
75 R B -1.5417 Soluble
76 F B 0.0000 Buried
77 T B -0.7844 Soluble
78 I B 0.0000 Buried
79 S B -0.4695 Soluble
80 R B -0.9751 Soluble
81 D B -1.5631 Soluble
82 N B -1.6968 Soluble
83 S B -1.5488 Soluble
84 K B -2.3356 Soluble
85 N B -1.6603 Soluble
86 T B -1.0321 Soluble
87 L B 0.0000 Buried
88 Y B -0.4680 Soluble
89 L B 0.0000 Buried
90 Q B -1.0672 Soluble
91 M B 0.0000 Buried
92 N B -1.9040 Soluble
93 S B -1.8055 Soluble
94 L B 0.0000 Buried
95 R B -2.5031 Soluble
96 A B -1.7255 Soluble
97 E B -2.2448 Soluble
98 D B 0.0000 Buried
99 T B -0.6572 Soluble
100 A B 0.0000 Buried
101 V B 0.0702 Aggregation-prone
102 Y B 0.0000 Buried
103 Y B 0.0000 Buried
104 C B 0.0000 Buried
105 A B 0.0000 Buried
106 R B -0.8541 Soluble
107 T B -0.7531 Soluble
108 G B -1.2569 Soluble
114 E B -1.5365 Soluble
115 Y B 0.2162 Aggregation-prone
116 S B -0.3244 Soluble
117 S B -0.4413 Soluble
118 W B -0.4559 Soluble
119 G B 0.0000 Buried
120 Q B -1.6138 Soluble
121 G B -0.7195 Soluble
122 T B -0.2910 Soluble
123 T B 0.0717 Aggregation-prone
124 V B 0.0000 Buried
125 T B -0.2854 Soluble
126 V B 0.0000 Buried
127 G B -0.5241 Soluble
128 G B -0.8817 Soluble
129 S B -0.5294 Soluble
130 T B -0.6632 Soluble
131 K B -1.1280 Soluble
132 G B -1.3324 Soluble
133 P B 0.0000 Buried
134 S B -0.3817 Soluble
135 V B 0.0000 Buried
136 F B 0.0000 Buried
137 P B -1.3422 Soluble
138 L B 0.0000 Buried
139 A B 0.0000 Buried
140 P B -0.4109 Soluble
141 C B -0.5507 Soluble
142 S B -0.5200 Soluble
143 E B -2.0068 Soluble
144 S B -1.2500 Soluble
145 T B -0.8349 Soluble
146 A B -0.5139 Soluble
147 A B 0.0000 Buried
148 L B 0.0000 Buried
149 G B 0.0000 Buried
150 C B 0.0000 Buried
151 L B 0.0000 Buried
152 V B 0.0000 Buried
153 K B 0.0000 Buried
154 D B -0.3318 Soluble
155 Y B 0.0000 Buried
156 F B 0.0000 Buried
157 P B -0.6757 Soluble
158 E B -0.7831 Soluble
159 P B -1.0266 Soluble
160 V B -0.8044 Soluble
161 T B -0.6031 Soluble
162 V B -0.1900 Soluble
163 S B -0.5215 Soluble
164 W B 0.0000 Buried
165 N B -1.0986 Soluble
166 S B -0.8296 Soluble
167 G B -0.6251 Soluble
168 A B -0.2918 Soluble
169 L B -0.0912 Soluble
170 T B -0.1929 Soluble
171 S B -0.1838 Soluble
172 G B -0.2208 Soluble
173 V B 0.1600 Aggregation-prone
174 H B -0.3124 Soluble
175 T B -0.0075 Soluble
176 F B 0.0000 Buried
177 P B -0.4251 Soluble
178 A B 0.2158 Aggregation-prone
179 V B 0.6581 Aggregation-prone
180 L B 1.3381 Aggregation-prone
181 Q B 0.3179 Aggregation-prone
182 S B -0.0211 Soluble
183 S B -0.2024 Soluble
184 G B 0.0192 Aggregation-prone
185 L B 0.1143 Aggregation-prone
186 Y B 0.3967 Aggregation-prone
187 S B 0.0000 Buried
188 L B 0.0000 Buried
189 S B 0.0000 Buried
190 S B 0.0000 Buried
191 V B 0.0000 Buried
192 V B 0.0000 Buried
193 T B -0.1311 Soluble
194 V B 0.0000 Buried
195 P B -0.7349 Soluble
196 S B -0.8980 Soluble
197 S B -0.7864 Soluble
198 S B -0.7364 Soluble
199 L B -0.8063 Soluble
200 G B -1.1446 Soluble
201 T B -1.0720 Soluble
202 K B -1.8489 Soluble
203 T B -1.4813 Soluble
204 Y B 0.0000 Buried
205 T B -1.7317 Soluble
206 C B 0.0000 Buried
207 N B -1.6811 Soluble
208 V B 0.0000 Buried
209 D B -1.8559 Soluble
210 H B 0.0000 Buried
211 K B -2.7972 Soluble
212 P B -1.7382 Soluble
213 S B -1.8598 Soluble
214 N B -2.5821 Soluble
215 T B -2.0670 Soluble
216 K B -2.6410 Soluble
217 V B -1.6997 Soluble
218 D B -2.7515 Soluble
219 K B -2.2468 Soluble
220 R B -2.7413 Soluble
221 V B 0.0000 Buried
222 H B -2.2795 Soluble
223 H B -1.9827 Soluble
224 H B -1.8261 Soluble
1 E A -1.5765 Soluble
2 I A -0.3320 Soluble
3 V A 0.7597 Aggregation-prone
4 L A 0.0000 Buried
5 T A -0.5869 Soluble
6 Q A -0.7061 Soluble
7 S A -0.6702 Soluble
8 P A -0.4451 Soluble
9 S A -0.5766 Soluble
10 S A -0.4063 Soluble
11 L A -0.1782 Soluble
12 S A -0.6373 Soluble
13 A A 0.0000 Buried
14 S A -0.2990 Soluble
15 V A 0.4258 Aggregation-prone
16 G A -0.8563 Soluble
17 D A -1.6876 Soluble
18 R A -2.6536 Soluble
19 V A 0.0000 Buried
20 T A -0.7036 Soluble
21 I A 0.0000 Buried
22 T A -0.7371 Soluble
23 C A 0.0000 Buried
24 R A -2.2059 Soluble
25 A A -1.1125 Soluble
26 S A -0.9857 Soluble
27 Q A -1.7853 Soluble
28 G A -1.8713 Soluble
29 I A 0.0000 Buried
36 G A -1.9795 Soluble
37 D A -2.6057 Soluble
38 D A -2.0670 Soluble
39 L A 0.0000 Buried
40 G A 0.0000 Buried
41 W A 0.0000 Buried
42 Y A 0.0000 Buried
43 Q A -0.1122 Soluble
44 Q A 0.0000 Buried
45 K A -1.4282 Soluble
46 P A -1.5160 Soluble
47 G A -1.6869 Soluble
48 K A -2.3614 Soluble
49 A A -1.2219 Soluble
50 P A 0.0000 Buried
51 I A 0.6237 Aggregation-prone
52 L A 0.7128 Aggregation-prone
53 L A 0.0000 Buried
54 I A 0.0000 Buried
55 Y A 0.2674 Aggregation-prone
56 G A -0.7814 Soluble
57 T A 0.0000 Buried
65 S A -0.5818 Soluble
66 T A 0.0237 Aggregation-prone
67 L A 0.1261 Aggregation-prone
68 Q A -0.4453 Soluble
69 S A -0.5765 Soluble
70 G A -0.6177 Soluble
71 V A -0.3031 Soluble
72 P A -0.3915 Soluble
74 S A -0.6360 Soluble
75 R A -1.2994 Soluble
76 F A 0.0000 Buried
77 S A -0.5264 Soluble
78 G A -0.2378 Soluble
79 S A -0.8621 Soluble
80 G A -1.4657 Soluble
83 S A -1.2860 Soluble
84 G A -1.7991 Soluble
85 T A -1.8528 Soluble
86 D A -1.7479 Soluble
87 F A 0.0000 Buried
88 T A -0.6664 Soluble
89 L A 0.0000 Buried
90 T A -0.9204 Soluble
91 I A 0.0000 Buried
92 N A -2.4527 Soluble
93 S A -1.6486 Soluble
94 L A 0.0000 Buried
95 Q A -1.0378 Soluble
96 P A -0.7298 Soluble
97 E A -1.5520 Soluble
98 D A 0.0000 Buried
99 F A -0.2477 Soluble
100 A A 0.0000 Buried
101 T A -0.5564 Soluble
102 Y A 0.0000 Buried
103 Y A 0.0000 Buried
104 C A 0.0000 Buried
105 L A 0.0094 Aggregation-prone
106 Q A 0.0000 Buried
107 D A -1.0563 Soluble
108 S A -1.2800 Soluble
109 N A -1.1960 Soluble
114 Y A 0.1034 Aggregation-prone
115 P A -0.3749 Soluble
116 L A -0.1128 Soluble
117 T A -0.1828 Soluble
118 F A 0.0000 Buried
119 G A 0.0000 Buried
120 G A -1.0358 Soluble
121 G A 0.0000 Buried
122 T A 0.0000 Buried
123 R A -0.7278 Soluble
124 L A 0.0000 Buried
125 E A 0.0000 Buried
126 I A -0.1497 Soluble
127 K A -1.1818 Soluble
128 R A -1.0029 Soluble
129 T A -0.0479 Soluble
130 V A 0.6317 Aggregation-prone
131 A A 0.2585 Aggregation-prone
132 A A -0.0567 Soluble
133 P A 0.0000 Buried
134 S A -0.1671 Soluble
135 V A 0.0000 Buried
136 F A -0.0832 Soluble
137 I A 0.0000 Buried
138 F A 0.0000 Buried
139 P A 0.0000 Buried
140 P A 0.0000 Buried
141 S A -1.7985 Soluble
142 D A -3.1120 Soluble
143 E A -3.0345 Soluble
144 Q A 0.0000 Buried
145 L A -2.2797 Soluble
146 K A -2.8497 Soluble
147 S A -1.7525 Soluble
148 G A -1.1398 Soluble
149 T A -0.9337 Soluble
150 A A 0.0000 Buried
151 S A 0.0000 Buried
152 V A 0.0000 Buried
153 V A 0.0000 Buried
154 C A 0.0000 Buried
155 L A 0.0000 Buried
156 L A 0.0000 Buried
157 N A 0.0000 Buried
158 N A -0.8043 Soluble
159 F A 0.0000 Buried
160 Y A 0.0000 Buried
161 P A -1.3329 Soluble
162 R A -2.0819 Soluble
163 E A -2.7342 Soluble
164 A A -1.8911 Soluble
165 K A -1.8323 Soluble
166 V A -0.9070 Soluble
167 Q A -0.7567 Soluble
168 W A 0.0000 Buried
169 K A -0.7783 Soluble
170 V A 0.0000 Buried
171 D A -2.0884 Soluble
172 N A -1.6433 Soluble
173 A A -0.4642 Soluble
174 L A 0.4087 Aggregation-prone
175 Q A -0.2402 Soluble
176 S A -0.4609 Soluble
177 G A -0.9015 Soluble
178 N A -0.7990 Soluble
179 S A -1.0742 Soluble
180 Q A -1.2312 Soluble
181 E A -1.2712 Soluble
182 S A -0.5246 Soluble
183 V A -0.5469 Soluble
184 T A -1.1171 Soluble
185 E A -2.1771 Soluble
186 Q A -1.7158 Soluble
187 D A -1.9249 Soluble
188 S A -1.6594 Soluble
189 K A -2.2157 Soluble
190 D A -1.6357 Soluble
191 S A -1.6214 Soluble
192 T A 0.0000 Buried
193 Y A 0.0000 Buried
194 S A 0.0000 Buried
195 L A 0.0000 Buried
196 S A 0.0000 Buried
197 S A 0.0000 Buried
198 T A -0.5726 Soluble
199 L A 0.0000 Buried
200 T A -0.4263 Soluble
201 L A -0.6038 Soluble
202 S A -1.1479 Soluble
203 K A -1.9143 Soluble
204 A A -1.7952 Soluble
205 D A -2.4548 Soluble
206 Y A 0.0000 Buried
207 E A -3.4390 Soluble
208 K A -3.5839 Soluble
209 H A -3.1616 Soluble
210 K A -3.4380 Soluble
211 V A -1.8684 Soluble
212 Y A 0.0000 Buried
213 A A 0.0000 Buried
214 C A 0.0000 Buried
215 E A -0.9920 Soluble
216 V A 0.0000 Buried
217 T A -1.0976 Soluble
218 H A 0.0000 Buried
219 Q A -1.5514 Soluble
220 G A -0.3231 Soluble
221 L A -0.1815 Soluble
222 S A -0.4461 Soluble
223 S A -0.4129 Soluble
224 P A -0.4860 Soluble
225 V A -0.0489 Soluble
226 T A -0.5852 Soluble
227 K A -0.8648 Soluble
228 S A -0.6837 Soluble
229 F A 0.0000 Buried
230 N A -1.8698 Soluble
231 R A -2.0779 Soluble
232 G A -2.1571 Soluble
233 E A -2.1783 Soluble
234 C A -0.7473 Soluble

3D Structure — colored by A4D score

Sequence - click residue to focus in viewer  |  colored by A4D score
Load structure to view sequence…
Color Legend (B-factor = A4D Score)
Score > 1.5 — highly aggregation-prone
Score 0.5–1.5 — aggregation-prone
Score ≈ 0 — buried
Score −1 to −0.5 — soluble
Score < −2.5 — highly soluble
pH Structure
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A4D Score Threshold
Highlight residues > threshold in the sequence panel
CDR Regions
HCDR1
HCDR2
HCDR3
LCDR1
LCDR2
LCDR3
Display Options

pH-Dependent Aggregation Profiles

A4D scores calculated across 11 pH conditions (4.0–9.0, step 0.5). Click a row to view the structure at that pH. The input structure is globular — max score is recommended for pH analysis.

pH Avg A4D Score Max A4D Score Downloads
4.0 -0.7617 1.6647 CSV PDB
4.5 -0.8078 1.5544 CSV PDB
5.0 -0.8619 1.5112 CSV PDB
5.5 -0.9137 1.4725 CSV PDB
6.0 -0.9521 1.4423 CSV PDB
6.5 -0.9682 1.4144 CSV PDB
7.0 -0.962 1.3919 CSV PDB
7.5 -0.9412 1.3753 CSV PDB
8.0 -0.9121 1.363 CSV PDB
8.5 -0.8768 1.3538 CSV PDB
9.0 -0.8351 1.4253 CSV PDB
Average A4D Score vs pH
Max A4D Score vs pH