Metelimumab / 6amm

A4DAB169_6amm_H_L | Source PDB: 6amm | Chains: H, L | Done
100
Yes
10 Å
Yes
Avg A4D Score
-0.7215
Max Score
1.1184
Min Score
-3.4692
Total Score
-306.63
Score CDR
-0.532
Score non-CDR
-0.771

Calculation Parameters

Chain Sequence(s) EVQLVESGGGVVQPGRSLRLSCAASGFTFSSYGMHWVRQAPGKELEWVAVISYDGSIKYYADSVKGRFTISRDNSKNTLYLQMNSLRAEDTAVYYCARTGEYSWGQGTTVTVSSASTKGPSVFPLAPCSESTAALGCLVKDYFPEPVTVSWNSGALTSGVHTFPAVLQSSGLYSLSSVVTVPSSSLGTKTYTCNVDHKPSNTKVDKRVHHEIVLTQSPSSLSASVGDRVTITCRASQGIGDDLGWYQQKPGKAPILLIYGTSTLQSGVPSRFSGSGSGTDFTLTINSLQPEDFATYYCLQDSNYPLTFGGGTRLEIKGRTVAAPSVFIFPPSDEQLKSGTASVVCLLNNFYPREAKVQWKVDNALQSGNSQESVTEQDSKDSTYSLSSTLTLSKADYEKHKVYACEVTHQGLSSPVTKSFNRGEC input.pdb
Selected Chain(s) H (Heavy), L (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 -3.4692
Maximum Score 1.1184
Average Score -0.7215
Total Score -306.6346

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

Index Residue Chain A4D Score Classification
1 E H -2.0737 Soluble
2 V H -1.3123 Soluble
3 Q H -1.2794 Soluble
4 L H 0.0000 Buried
5 V H 1.0344 Aggregation-prone
6 E H 0.0000 Buried
7 S H -0.4648 Soluble
8 G H -1.0332 Soluble
9 G H -0.4663 Soluble
11 G H 0.3756 Aggregation-prone
12 V H 0.9524 Aggregation-prone
13 V H 0.0000 Buried
14 Q H -1.5497 Soluble
15 P H -1.9879 Soluble
16 G H -2.1179 Soluble
17 R H -2.5405 Soluble
18 S H -2.0218 Soluble
19 L H -1.3631 Soluble
20 R H -2.2863 Soluble
21 L H 0.0000 Buried
22 S H -0.5165 Soluble
23 C H 0.0000 Buried
24 A H -0.1028 Soluble
25 A H 0.0000 Buried
26 S H -0.7803 Soluble
27 G H -1.1767 Soluble
28 F H -0.5111 Soluble
29 T H -0.1995 Soluble
30 F H 0.0000 Buried
35 S H -0.7017 Soluble
36 S H -0.0528 Soluble
37 Y H 0.0953 Aggregation-prone
38 G H -0.0763 Soluble
39 M H 0.0000 Buried
40 H H 0.0000 Buried
41 W H 0.0000 Buried
42 V H 0.0000 Buried
43 R H 0.0000 Buried
44 Q H -1.1345 Soluble
45 A H -1.4472 Soluble
46 P H -1.1140 Soluble
47 G H -1.6643 Soluble
48 K H -2.7417 Soluble
49 E H -2.3951 Soluble
50 L H 0.0000 Buried
51 E H -1.4887 Soluble
52 W H 0.0000 Buried
53 V H 0.0000 Buried
54 A H 0.0000 Buried
55 V H 0.0000 Buried
56 I H 0.0000 Buried
57 S H 0.2850 Aggregation-prone
58 Y H 0.4605 Aggregation-prone
59 D H -1.2700 Soluble
62 G H -0.6901 Soluble
63 S H -0.1171 Soluble
64 I H 0.9413 Aggregation-prone
65 K H 0.3072 Aggregation-prone
66 Y H 0.5268 Aggregation-prone
67 Y H -0.4870 Soluble
68 A H -1.3885 Soluble
69 D H -2.3391 Soluble
70 S H -1.7440 Soluble
71 V H 0.0000 Buried
72 K H -2.4240 Soluble
74 G H -1.7016 Soluble
75 R H -1.2631 Soluble
76 F H 0.0000 Buried
77 T H -0.9525 Soluble
78 I H 0.0000 Buried
79 S H -0.6991 Soluble
80 R H 0.0000 Buried
81 D H -1.7170 Soluble
82 N H -1.7559 Soluble
83 S H -1.6134 Soluble
84 K H -2.3624 Soluble
85 N H -1.7672 Soluble
86 T H 0.0000 Buried
87 L H 0.0000 Buried
88 Y H -0.6514 Soluble
89 L H 0.0000 Buried
90 Q H -1.6453 Soluble
91 M H 0.0000 Buried
92 N H -1.7739 Soluble
93 S H -1.6939 Soluble
94 L H 0.0000 Buried
95 R H -2.8388 Soluble
96 A H -1.8619 Soluble
97 E H -2.3679 Soluble
98 D H 0.0000 Buried
99 T H -0.7535 Soluble
100 A H 0.0000 Buried
101 V H 0.0003 Aggregation-prone
102 Y H 0.0000 Buried
103 Y H 0.0000 Buried
104 C H 0.0000 Buried
105 A H 0.0000 Buried
106 R H -0.1743 Soluble
107 T H -0.5176 Soluble
108 G H -0.8262 Soluble
115 E H -1.8782 Soluble
116 Y H 0.4214 Aggregation-prone
117 S H 0.1190 Aggregation-prone
118 W H 0.1148 Aggregation-prone
119 G H 0.0000 Buried
120 Q H -1.2935 Soluble
121 G H 0.0000 Buried
122 T H -0.2053 Soluble
123 T H -0.0606 Soluble
124 V H 0.0000 Buried
125 T H -0.1481 Soluble
126 V H 0.0000 Buried
127 S H -0.6843 Soluble
128 S H -0.4804 Soluble
129 A H -0.3503 Soluble
130 S H -0.4598 Soluble
131 T H -0.5957 Soluble
132 K H -1.1982 Soluble
133 G H -1.3930 Soluble
134 P H -0.5648 Soluble
135 S H -0.2806 Soluble
136 V H 0.0000 Buried
137 F H 0.0000 Buried
138 P H -1.1810 Soluble
139 L H 0.0000 Buried
140 A H -0.4827 Soluble
141 P H -0.2426 Soluble
142 C H -0.4383 Soluble
143 S H -0.4480 Soluble
144 E H -2.0041 Soluble
145 S H -1.2453 Soluble
146 T H -0.8467 Soluble
147 A H -0.6290 Soluble
148 A H 0.0000 Buried
149 L H 0.0000 Buried
150 G H 0.0000 Buried
151 C H 0.0000 Buried
152 L H 0.0000 Buried
153 V H 0.0000 Buried
154 K H 0.0000 Buried
155 D H -0.3446 Soluble
156 Y H 0.0000 Buried
157 F H 0.0000 Buried
158 P H -0.7528 Soluble
159 E H -0.9843 Soluble
160 P H -1.1171 Soluble
161 V H -0.8213 Soluble
162 T H -0.5870 Soluble
163 V H -0.1721 Soluble
164 S H -0.5055 Soluble
165 W H 0.0000 Buried
166 N H -1.1571 Soluble
167 S H -0.8256 Soluble
168 G H -0.6002 Soluble
169 A H -0.2823 Soluble
170 L H -0.1137 Soluble
171 T H -0.2106 Soluble
172 S H -0.2039 Soluble
173 G H -0.2317 Soluble
174 V H 0.1043 Aggregation-prone
175 H H -0.3481 Soluble
176 T H -0.0105 Soluble
177 F H 0.0000 Buried
178 P H -0.4009 Soluble
179 A H 0.0575 Aggregation-prone
180 V H 0.4624 Aggregation-prone
181 L H 1.1184 Aggregation-prone
182 Q H 0.3075 Aggregation-prone
183 S H -0.0391 Soluble
184 S H -0.1908 Soluble
185 G H 0.0513 Aggregation-prone
186 L H 0.0545 Aggregation-prone
187 Y H 0.3117 Aggregation-prone
188 S H 0.0000 Buried
189 L H 0.0000 Buried
190 S H 0.0000 Buried
191 S H 0.0000 Buried
192 V H 0.0000 Buried
193 V H 0.0000 Buried
194 T H -0.1423 Soluble
195 V H 0.0000 Buried
196 P H -0.5954 Soluble
197 S H -0.7475 Soluble
198 S H -0.7461 Soluble
199 S H 0.0000 Buried
200 L H -0.8202 Soluble
201 G H -1.0977 Soluble
202 T H -1.0717 Soluble
203 K H -1.8289 Soluble
204 T H -1.5065 Soluble
205 Y H 0.0000 Buried
206 T H -1.9037 Soluble
207 C H 0.0000 Buried
208 N H -1.7240 Soluble
209 V H 0.0000 Buried
210 D H -1.7930 Soluble
211 H H 0.0000 Buried
212 K H -2.8113 Soluble
213 P H -1.7712 Soluble
214 S H -1.8509 Soluble
215 N H -2.5878 Soluble
216 T H -2.0671 Soluble
217 K H -2.6621 Soluble
218 V H -1.7399 Soluble
219 D H -2.8463 Soluble
220 K H -2.4078 Soluble
221 R H -2.9508 Soluble
222 V H 0.0000 Buried
223 H H -2.0098 Soluble
224 H H -1.6877 Soluble
1 E L -1.5641 Soluble
2 I L -0.5102 Soluble
3 V L 0.5941 Aggregation-prone
4 L L 0.0000 Buried
5 T L -0.3166 Soluble
6 Q L -0.4649 Soluble
7 S L -0.5448 Soluble
8 P L -0.4824 Soluble
9 S L -0.5657 Soluble
10 S L -0.4448 Soluble
11 L L -0.2254 Soluble
12 S L -0.6628 Soluble
13 A L 0.0000 Buried
14 S L -0.9221 Soluble
15 V L 0.0177 Aggregation-prone
16 G L -1.0886 Soluble
17 D L -2.2787 Soluble
18 R L -2.5784 Soluble
19 V L -1.2501 Soluble
20 T L -0.6031 Soluble
21 I L 0.0000 Buried
22 T L -0.6866 Soluble
23 C L 0.0000 Buried
24 R L -1.3628 Soluble
25 A L 0.0000 Buried
26 S L -0.8328 Soluble
27 Q L -1.7152 Soluble
28 G L -1.8380 Soluble
29 I L 0.0000 Buried
36 G L -2.2249 Soluble
37 D L -2.7953 Soluble
38 D L -2.5635 Soluble
39 L L 0.0000 Buried
40 G L 0.0000 Buried
41 W L 0.0000 Buried
42 Y L 0.0000 Buried
43 Q L 0.0000 Buried
44 Q L 0.0000 Buried
45 K L -1.3824 Soluble
46 P L -1.5510 Soluble
47 G L -1.6832 Soluble
48 K L -2.2715 Soluble
49 A L -1.1476 Soluble
50 P L 0.0000 Buried
51 I L 0.8202 Aggregation-prone
52 L L 0.8077 Aggregation-prone
53 L L 0.0000 Buried
54 I L 0.0000 Buried
55 Y L -0.0401 Soluble
56 G L -1.0818 Soluble
57 T L -1.0964 Soluble
65 S L -0.5963 Soluble
66 T L -0.2500 Soluble
67 L L 0.2909 Aggregation-prone
68 Q L -0.1141 Soluble
69 S L -0.4228 Soluble
70 G L -0.4941 Soluble
71 V L -0.0681 Soluble
72 P L -0.4044 Soluble
74 S L -0.5107 Soluble
75 R L -0.9794 Soluble
76 F L 0.0000 Buried
77 S L -0.3568 Soluble
78 G L -0.2452 Soluble
79 S L -0.9334 Soluble
80 G L -1.4238 Soluble
83 S L -1.8000 Soluble
84 G L -1.8938 Soluble
85 T L -1.9778 Soluble
86 D L -2.4410 Soluble
87 F L 0.0000 Buried
88 T L -0.7500 Soluble
89 L L 0.0000 Buried
90 T L -0.6317 Soluble
91 I L 0.0000 Buried
92 N L -1.7422 Soluble
93 S L -1.4247 Soluble
94 L L 0.0000 Buried
95 Q L -1.1272 Soluble
96 P L -0.9846 Soluble
97 E L -1.9290 Soluble
98 D L 0.0000 Buried
99 F L -0.3704 Soluble
100 A L 0.0000 Buried
101 T L -0.3726 Soluble
102 Y L 0.0000 Buried
103 Y L 0.0000 Buried
104 C L 0.0000 Buried
105 L L 0.0000 Buried
106 Q L 0.0000 Buried
107 D L -1.6979 Soluble
108 S L -1.6368 Soluble
109 N L -1.5911 Soluble
114 Y L -0.3162 Soluble
115 P L -0.7543 Soluble
116 L L -0.5176 Soluble
117 T L -0.4300 Soluble
118 F L 0.0000 Buried
119 G L 0.0000 Buried
120 G L -1.0900 Soluble
121 G L -1.0120 Soluble
122 T L 0.0000 Buried
123 R L -0.5603 Soluble
124 L L 0.0000 Buried
125 E L 0.0000 Buried
126 I L -0.6587 Soluble
127 K L -1.7742 Soluble
128 G L -1.6211 Soluble
129 R L -2.1203 Soluble
130 T L -0.7443 Soluble
131 V L 0.4293 Aggregation-prone
132 A L -0.0802 Soluble
133 A L -0.1055 Soluble
134 P L 0.0000 Buried
135 S L -0.1092 Soluble
136 V L 0.0000 Buried
137 F L 0.0178 Aggregation-prone
138 I L 0.0000 Buried
139 F L 0.0000 Buried
140 P L 0.0000 Buried
141 P L -0.6732 Soluble
142 S L -1.4879 Soluble
143 D L -2.8342 Soluble
144 E L -3.0496 Soluble
145 Q L 0.0000 Buried
146 L L -2.2266 Soluble
147 K L -2.8687 Soluble
148 S L -1.7716 Soluble
149 G L -1.4270 Soluble
150 T L -1.0805 Soluble
151 A L 0.0000 Buried
152 S L 0.0000 Buried
153 V L 0.0000 Buried
154 V L 0.0000 Buried
155 C L 0.0000 Buried
156 L L 0.0000 Buried
157 L L 0.0000 Buried
158 N L 0.0000 Buried
159 N L -0.7341 Soluble
160 F L 0.0000 Buried
161 Y L 0.0000 Buried
162 P L -1.4300 Soluble
163 R L -2.1390 Soluble
164 E L -2.8042 Soluble
165 A L -2.0847 Soluble
166 K L -2.2325 Soluble
167 V L -0.9383 Soluble
168 Q L -0.4178 Soluble
169 W L 0.0000 Buried
170 K L -0.4425 Soluble
171 V L 0.0000 Buried
172 D L -1.8807 Soluble
173 N L -1.3156 Soluble
174 A L -0.2939 Soluble
175 L L 0.7975 Aggregation-prone
176 Q L -0.0380 Soluble
177 S L -0.4589 Soluble
178 G L -0.8970 Soluble
179 N L -0.8485 Soluble
180 S L -1.1509 Soluble
181 Q L -1.4475 Soluble
182 E L -1.9803 Soluble
183 S L -1.0776 Soluble
184 V L -0.7935 Soluble
185 T L -1.0464 Soluble
186 E L -2.1054 Soluble
187 Q L -1.7774 Soluble
188 D L -1.9690 Soluble
189 S L -1.7682 Soluble
190 K L -2.2692 Soluble
191 D L -1.9297 Soluble
192 S L 0.0000 Buried
193 T L 0.0000 Buried
194 Y L 0.0000 Buried
195 S L 0.0000 Buried
196 L L 0.0000 Buried
197 S L 0.0000 Buried
198 S L 0.0000 Buried
199 T L -0.7064 Soluble
200 L L 0.0000 Buried
201 T L -0.4054 Soluble
202 L L -0.7089 Soluble
203 S L -1.1177 Soluble
204 K L -2.0249 Soluble
205 A L -1.8546 Soluble
206 D L -2.7620 Soluble
207 Y L 0.0000 Buried
208 E L -3.0262 Soluble
209 K L -3.4692 Soluble
210 H L -2.8377 Soluble
211 K L -2.8642 Soluble
212 V L -1.2823 Soluble
213 Y L 0.0000 Buried
214 A L 0.0000 Buried
215 C L 0.0000 Buried
216 E L -0.8144 Soluble
217 V L 0.0000 Buried
218 T L -1.1900 Soluble
219 H L 0.0000 Buried
220 Q L -1.6636 Soluble
221 G L -0.4063 Soluble
222 L L -0.2181 Soluble
223 S L -0.4871 Soluble
224 S L -0.4501 Soluble
225 P L -0.6017 Soluble
226 V L -0.1299 Soluble
227 T L -0.5093 Soluble
228 K L -0.7597 Soluble
229 S L -0.4906 Soluble
230 F L 0.0000 Buried
231 N L -1.6395 Soluble
232 R L -2.0643 Soluble
233 G L -1.5718 Soluble
234 E L -1.8923 Soluble
235 C L -0.6573 Soluble

3D Structure — colored by A4D score

Sequence - click residue to focus in viewer  |  colored by A4D score
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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 -0.7061 1.7016 CSV PDB
4.5 -0.7576 1.6352 CSV PDB
5.0 -0.8185 1.541 CSV PDB
5.5 -0.8777 1.4356 CSV PDB
6.0 -0.924 1.3355 CSV PDB
6.5 -0.9486 1.2565 CSV PDB
7.0 -0.9509 1.2147 CSV PDB
7.5 -0.9383 1.2152 CSV PDB
8.0 -0.9174 1.3046 CSV PDB
8.5 -0.8895 1.3951 CSV PDB
9.0 -0.8538 1.485 CSV PDB
Average A4D Score vs pH
Max A4D Score vs pH