Metelimumab / 6anp

A4DAB169_6anp_H_L | Source PDB: 6anp | Chains: H, L | Done
99.13
Yes
10 Å
Yes
Avg A4D Score
-0.7076
Max Score
1.3454
Min Score
-3.3436
Total Score
-303.55
Score CDR
-0.5279
Score non-CDR
-0.758

Calculation Parameters

Chain Sequence(s) QLVESGGGVVQPGRSLRLSCAASGFTFSSYGMHWVRQAPGKELEWVAVISYDGSIKYYADSVKGRFTISRDNSKNTLYLQMNSLRAEDTAVYYCARTSWGQGTTVTVGGGGSSSASTKGPSVFPLAPCSRSTSESTAALGCLVKDYFPEPVTVSWNSGALTSGVHTFPAVLQSSGLYSLSSVVTVPSSSLGTKTYTCNVDHKPSNTKVDKRVHHHEIVLTQSPSSLSASVGDRVTITCRASQGIGDDLGWYQQKPGKAPILLIYGTSTLQSGVPSRFSGSGSGTDFTLTINSLQPEDFATYYCLQDSNYPLTFGGGTRLEIKRTVAAPSVFIFPPSDEQLKSGTASVVCLLNNFYPREAKVQWKVDNALQSGNSQESVTEQDSKDSTYSLSSTLTLSKADYEKHKVYACEVTHQGLSSPVTKSFNRGEC 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 -3.3436
Maximum Score 1.3454
Average Score -0.7076
Total Score -303.5485

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

Index Residue Chain A4D Score Classification
3 Q H -1.3667 Soluble
4 L H 0.0000 Buried
5 V H -0.0019 Soluble
6 E H 0.0000 Buried
7 S H -0.6266 Soluble
8 G H -0.9519 Soluble
9 G H -0.5180 Soluble
11 G H 0.1755 Aggregation-prone
12 V H 0.6590 Aggregation-prone
13 V H 0.0000 Buried
14 Q H -1.9976 Soluble
15 P H -1.9886 Soluble
16 G H -2.2462 Soluble
17 R H -2.8435 Soluble
18 S H -2.0989 Soluble
19 L H -1.4510 Soluble
20 R H -2.1043 Soluble
21 L H 0.0000 Buried
22 S H -0.5614 Soluble
23 C H 0.0000 Buried
24 A H -0.3496 Soluble
25 A H -0.7839 Soluble
26 S H -0.8240 Soluble
27 G H -0.7028 Soluble
28 F H -0.1591 Soluble
29 T H -0.1068 Soluble
30 F H 0.0000 Buried
35 S H -0.5799 Soluble
36 S H 0.1014 Aggregation-prone
37 Y H 0.5477 Aggregation-prone
38 G H 0.2565 Aggregation-prone
39 M H 0.0000 Buried
40 H H -0.2585 Soluble
41 W H 0.0000 Buried
42 V H 0.0000 Buried
43 R H 0.0000 Buried
44 Q H -1.0218 Soluble
45 A H -1.3835 Soluble
46 P H -1.1329 Soluble
47 G H -1.6079 Soluble
48 K H -2.5886 Soluble
49 E H -2.0757 Soluble
50 L H 0.0000 Buried
51 E H -1.0349 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 0.3616 Aggregation-prone
58 Y H 0.5512 Aggregation-prone
59 D H -1.1629 Soluble
62 G H -0.6227 Soluble
63 S H -0.0765 Soluble
64 I H 0.9625 Aggregation-prone
65 K H 0.1524 Aggregation-prone
66 Y H 0.3695 Aggregation-prone
67 Y H -0.5673 Soluble
68 A H 0.0000 Buried
69 D H -2.6647 Soluble
70 S H -1.7297 Soluble
71 V H 0.0000 Buried
72 K H -2.5239 Soluble
74 G H -1.6821 Soluble
75 R H 0.0000 Buried
76 F H 0.0000 Buried
77 T H -0.8569 Soluble
78 I H 0.0000 Buried
79 S H -0.4402 Soluble
80 R H -0.9653 Soluble
81 D H -1.5199 Soluble
82 N H -1.6947 Soluble
83 S H -1.5413 Soluble
84 K H -2.2990 Soluble
85 N H -1.6161 Soluble
86 T H -0.9720 Soluble
87 L H 0.0000 Buried
88 Y H -0.5443 Soluble
89 L H 0.0000 Buried
90 Q H -1.3020 Soluble
91 M H 0.0000 Buried
92 N H -1.8754 Soluble
93 S H -1.7885 Soluble
94 L H 0.0000 Buried
95 R H -2.4638 Soluble
96 A H -1.7078 Soluble
97 E H -2.1995 Soluble
98 D H 0.0000 Buried
99 T H -0.7221 Soluble
100 A H 0.0000 Buried
101 V H -0.1087 Soluble
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 -0.7359 Soluble
116 T H -0.1606 Soluble
117 S H -0.3538 Soluble
118 W H -0.2011 Soluble
119 G H 0.0000 Buried
120 Q H -1.6555 Soluble
121 G H -0.8085 Soluble
122 T H -0.3813 Soluble
123 T H -0.1487 Soluble
124 V H 0.0000 Buried
125 T H -0.3577 Soluble
126 V H 0.0000 Buried
127 G H -0.9703 Soluble
128 G H -0.7750 Soluble
129 G H -0.6981 Soluble
130 G H -0.7578 Soluble
131 S H -0.6467 Soluble
132 S H -0.6587 Soluble
133 S H -0.4117 Soluble
134 A H -0.4554 Soluble
135 S H -0.5926 Soluble
136 T H -0.9164 Soluble
137 K H -1.1990 Soluble
138 G H -1.3820 Soluble
139 P H -0.6321 Soluble
140 S H -0.3914 Soluble
141 V H 0.0000 Buried
142 F H -0.6476 Soluble
143 P H 0.0000 Buried
144 L H 0.0000 Buried
145 A H 0.0000 Buried
146 P H -0.4411 Soluble
147 C H -0.7626 Soluble
148 S H -1.1896 Soluble
149 R H -2.2319 Soluble
150 S H -1.5948 Soluble
151 T H -1.2228 Soluble
152 S H -1.2105 Soluble
153 E H -1.9334 Soluble
154 S H -1.2844 Soluble
155 T H -0.9045 Soluble
156 A H 0.0000 Buried
157 A H 0.0000 Buried
158 L H 0.0000 Buried
159 G H 0.0000 Buried
160 C H 0.0000 Buried
161 L H 0.0000 Buried
162 V H 0.0000 Buried
163 K H 0.0000 Buried
164 D H -0.5672 Soluble
165 Y H 0.0000 Buried
166 F H 0.0000 Buried
167 P H -0.8309 Soluble
168 E H -1.1908 Soluble
169 P H -1.0592 Soluble
170 V H -0.7801 Soluble
171 T H -0.5835 Soluble
172 V H -0.3528 Soluble
173 S H -0.4945 Soluble
174 W H 0.0000 Buried
175 N H -1.0891 Soluble
176 S H -0.8139 Soluble
177 G H -0.5978 Soluble
178 A H -0.2855 Soluble
179 L H -0.1140 Soluble
180 T H -0.2119 Soluble
181 S H -0.2036 Soluble
182 G H -0.2527 Soluble
183 V H 0.1240 Aggregation-prone
184 H H -0.3592 Soluble
185 T H -0.0007 Soluble
186 F H 0.0000 Buried
187 P H -0.4346 Soluble
188 A H 0.2224 Aggregation-prone
189 V H 0.5790 Aggregation-prone
190 L H 1.3454 Aggregation-prone
191 Q H 0.2020 Aggregation-prone
192 S H -0.0673 Soluble
193 S H -0.2831 Soluble
194 G H -0.0820 Soluble
195 L H 0.0000 Buried
196 Y H 0.2410 Aggregation-prone
197 S H 0.0000 Buried
198 L H 0.2139 Aggregation-prone
199 S H 0.0000 Buried
200 S H 0.0000 Buried
201 V H 0.0000 Buried
202 V H 0.0000 Buried
203 T H -0.1234 Soluble
204 V H 0.0000 Buried
205 P H -0.6859 Soluble
206 S H 0.0000 Buried
207 S H -0.8816 Soluble
208 S H -1.0502 Soluble
209 L H 0.0000 Buried
210 G H -1.4443 Soluble
211 T H -1.2299 Soluble
212 K H -1.9108 Soluble
213 T H -1.5430 Soluble
214 Y H 0.0000 Buried
215 T H -1.8703 Soluble
216 C H 0.0000 Buried
217 N H -1.6945 Soluble
218 V H 0.0000 Buried
219 D H -1.8364 Soluble
220 H H 0.0000 Buried
221 K H -2.8340 Soluble
222 P H -1.7430 Soluble
223 S H -1.8304 Soluble
224 N H -2.6004 Soluble
225 T H -2.0940 Soluble
226 K H -2.6609 Soluble
227 V H -1.7369 Soluble
228 D H -2.8127 Soluble
229 K H -2.3183 Soluble
230 R H -2.7807 Soluble
231 V H 0.0000 Buried
232 H H -2.0335 Soluble
233 H H -1.4499 Soluble
234 H H -1.5660 Soluble
1 E L -1.6900 Soluble
2 I L 0.0000 Buried
3 V L 0.5323 Aggregation-prone
4 L L 0.0000 Buried
5 T L -0.6625 Soluble
6 Q L -0.7170 Soluble
7 S L -0.7043 Soluble
8 P L -0.4718 Soluble
9 S L -0.6067 Soluble
10 S L -0.4133 Soluble
11 L L -0.1964 Soluble
12 S L -0.5559 Soluble
13 A L 0.0000 Buried
14 S L -0.7529 Soluble
15 V L -0.2379 Soluble
16 G L -1.0690 Soluble
17 D L -1.8656 Soluble
18 R L -2.5036 Soluble
19 V L 0.0000 Buried
20 T L -0.6415 Soluble
21 I L 0.0000 Buried
22 T L -0.7743 Soluble
23 C L 0.0000 Buried
24 R L -2.2568 Soluble
25 A L 0.0000 Buried
26 S L -1.1311 Soluble
27 Q L -1.8632 Soluble
28 G L -1.8541 Soluble
29 I L 0.0000 Buried
36 G L -1.9178 Soluble
37 D L -2.4875 Soluble
38 D L -1.9308 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 0.1341 Aggregation-prone
44 Q L 0.0000 Buried
45 K L -1.3558 Soluble
46 P L -1.5058 Soluble
47 G L -1.6871 Soluble
48 K L -2.2694 Soluble
49 A L -1.0589 Soluble
50 P L 0.0000 Buried
51 I L 1.2333 Aggregation-prone
52 L L 1.0541 Aggregation-prone
53 L L 0.0000 Buried
54 I L 0.0000 Buried
55 Y L 0.5767 Aggregation-prone
56 G L -0.6824 Soluble
57 T L 0.0000 Buried
65 S L -0.5006 Soluble
66 T L -0.0717 Soluble
67 L L 0.1421 Aggregation-prone
68 Q L -0.3667 Soluble
69 S L -0.6695 Soluble
70 G L -0.6540 Soluble
71 V L -0.1811 Soluble
72 P L -0.4186 Soluble
74 S L -0.5500 Soluble
75 R L -0.9439 Soluble
76 F L 0.0000 Buried
77 S L -0.3759 Soluble
78 G L -0.1834 Soluble
79 S L -0.8488 Soluble
80 G L -1.3214 Soluble
83 S L -1.2658 Soluble
84 G L -1.7442 Soluble
85 T L -1.8424 Soluble
86 D L -1.8248 Soluble
87 F L 0.0000 Buried
88 T L -0.6800 Soluble
89 L L 0.0000 Buried
90 T L -0.7180 Soluble
91 I L 0.0000 Buried
92 N L -1.6859 Soluble
93 S L -1.4345 Soluble
94 L L 0.0000 Buried
95 Q L -1.0579 Soluble
96 P L -0.9730 Soluble
97 E L -1.9054 Soluble
98 D L 0.0000 Buried
99 F L -0.3668 Soluble
100 A L 0.0000 Buried
101 T L -0.5482 Soluble
102 Y L 0.0000 Buried
103 Y L 0.0000 Buried
104 C L 0.0000 Buried
105 L L 0.2260 Aggregation-prone
106 Q L 0.0000 Buried
107 D L -0.9734 Soluble
108 S L -1.2686 Soluble
109 N L -1.1812 Soluble
114 Y L 0.3192 Aggregation-prone
115 P L -0.3096 Soluble
116 L L -0.0550 Soluble
117 T L -0.0902 Soluble
118 F L 0.0000 Buried
119 G L 0.0000 Buried
120 G L -1.0026 Soluble
121 G L 0.0000 Buried
122 T L 0.0000 Buried
123 R L -0.7900 Soluble
124 L L 0.0000 Buried
125 E L 0.0000 Buried
126 I L -0.2735 Soluble
127 K L -1.3776 Soluble
128 R L -0.9237 Soluble
129 T L 0.0982 Aggregation-prone
130 V L 0.9704 Aggregation-prone
131 A L 0.4376 Aggregation-prone
132 A L 0.0209 Aggregation-prone
133 P L 0.0000 Buried
134 S L -0.1583 Soluble
135 V L 0.0000 Buried
136 F L 0.1193 Aggregation-prone
137 I L 0.1388 Aggregation-prone
138 F L 0.0000 Buried
139 P L -0.2415 Soluble
140 P L -0.7184 Soluble
141 S L -1.7824 Soluble
142 D L -3.0960 Soluble
143 E L -2.7764 Soluble
144 Q L 0.0000 Buried
145 L L -2.3558 Soluble
146 K L -2.8740 Soluble
147 S L -1.7778 Soluble
148 G L -1.5640 Soluble
149 T L -1.2042 Soluble
150 A L 0.0000 Buried
151 S L 0.0000 Buried
152 V L 0.0000 Buried
153 V L 0.0000 Buried
154 C L 0.0000 Buried
155 L L 0.0000 Buried
156 L L 0.0000 Buried
157 N L 0.0000 Buried
158 N L -0.8551 Soluble
159 F L 0.0000 Buried
160 Y L 0.0000 Buried
161 P L -1.2986 Soluble
162 R L -2.2327 Soluble
163 E L -2.7766 Soluble
164 A L -1.9701 Soluble
165 K L -2.0325 Soluble
166 V L -0.9290 Soluble
167 Q L -0.6734 Soluble
168 W L 0.0000 Buried
169 K L -0.6244 Soluble
170 V L 0.0000 Buried
171 D L -1.3940 Soluble
172 N L -1.2314 Soluble
173 A L -0.2447 Soluble
174 L L 0.5662 Aggregation-prone
175 Q L -0.3660 Soluble
176 S L -0.6517 Soluble
177 G L -1.2761 Soluble
178 N L -1.5352 Soluble
179 S L -1.6089 Soluble
180 Q L -1.8283 Soluble
181 E L -1.7727 Soluble
182 S L -0.9338 Soluble
183 V L -0.7040 Soluble
184 T L -1.1708 Soluble
185 E L -2.2448 Soluble
186 Q L -1.8448 Soluble
187 D L -2.0671 Soluble
188 S L -1.7778 Soluble
189 K L -2.2188 Soluble
190 D L -1.6483 Soluble
191 S L -1.6993 Soluble
192 T L 0.0000 Buried
193 Y L 0.0000 Buried
194 S L 0.0000 Buried
195 L L 0.0000 Buried
196 S L 0.0000 Buried
197 S L 0.0000 Buried
198 T L -0.8347 Soluble
199 L L 0.0000 Buried
200 T L -0.6862 Soluble
201 L L -0.7368 Soluble
202 S L -1.2203 Soluble
203 K L -2.3375 Soluble
204 A L -1.8181 Soluble
205 D L -2.2511 Soluble
206 Y L 0.0000 Buried
207 E L -3.2861 Soluble
208 K L -3.3436 Soluble
209 H L -2.6559 Soluble
210 K L -2.9055 Soluble
211 V L -1.3442 Soluble
212 Y L 0.0000 Buried
213 A L 0.0000 Buried
214 C L 0.0000 Buried
215 E L -0.9006 Soluble
216 V L 0.0000 Buried
217 T L -1.1421 Soluble
218 H L 0.0000 Buried
219 Q L -1.4973 Soluble
220 G L -0.2482 Soluble
221 L L -0.1730 Soluble
222 S L -0.4613 Soluble
223 S L -0.4581 Soluble
224 P L -0.5954 Soluble
225 V L -0.0757 Soluble
226 T L -0.4386 Soluble
227 K L -0.5090 Soluble
228 S L -0.4178 Soluble
229 F L 0.0000 Buried
230 N L -1.5862 Soluble
231 R L -2.1312 Soluble
232 G L -1.8223 Soluble
233 E L -2.1081 Soluble
234 C L -0.6841 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
Load structure at specific pH condition
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 -0.7737 1.637 CSV PDB
4.5 -0.816 1.5992 CSV PDB
5.0 -0.8652 1.5631 CSV PDB
5.5 -0.9121 1.5779 CSV PDB
6.0 -0.9471 1.6073 CSV PDB
6.5 -0.9617 1.6565 CSV PDB
7.0 -0.9551 1.7244 CSV PDB
7.5 -0.9336 1.8035 CSV PDB
8.0 -0.9035 1.8872 CSV PDB
8.5 -0.867 1.9722 CSV PDB
9.0 -0.8245 2.0565 CSV PDB
Average A4D Score vs pH
Max A4D Score vs pH