Volagidemab / 4lf3

A4DAB298_4lf3_E_D | Source PDB: 4lf3 | Chains: E, D | Done
99.58
Yes
10 Å
Yes
Avg A4D Score
-0.7535
Max Score
2.7474
Min Score
-3.7141
Total Score
-335.31
Score CDR
-0.3789
Score non-CDR
-0.8063

Calculation Parameters

Chain Sequence(s) QVQLVESGGGVVQPGRSLRLSCAASGFTFSSYGMHWVRQAPGKGLEWVAVMWYDGSNKDYVDSVKGRFTISRDNSKNTLYLQMNRLRAEDTAVYYCAREKDHYDILTGYNYYYGLDVWGQGTTVTVSSASTKGPSVFPLAPSSKSTSGGTAALGCLVKDYFPEPVTVSWNSGALTSGVHTFPAVLQSSGLYSLSSVVTVPSSSLGTQTYICNVNHKPSNTKVDKKVEPKSCDIQMTQSPSSLSASVGDRVTITCRASQGIRNDLGWYQQKPGKAPKRLIYAASSLESGVPSRFSGSGSGTEFTLTISSVQPEDFVTYYCLQHNSNPLTFGGGTKVEIKRTVAAPSVFIFPPSDEQLKSGTASVVCLLNNFYPREAKVQWKVDNALQSGNSQESVTEQDSKDSTYSLSSTLTLSKADYEKHKVYACEVTHQGLSSPVTKSFNRGEC input.pdb
Selected Chain(s) E (Heavy), D (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 -3.7141
Maximum Score 2.7474
Average Score -0.7535
Total Score -335.3087

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

Index Residue Chain A4D Score Classification
1 Q E -1.3495 Soluble
2 V E -0.7507 Soluble
3 Q E -0.8086 Soluble
4 L E 0.0000 Buried
5 V E 0.7668 Aggregation-prone
6 E E 0.0000 Buried
7 S E -0.5698 Soluble
8 G E -1.0227 Soluble
9 G E -0.5897 Soluble
11 G E -0.0896 Soluble
12 V E 0.2843 Aggregation-prone
13 V E 0.0000 Buried
14 Q E -2.3304 Soluble
15 P E -2.5358 Soluble
16 G E -3.0045 Soluble
17 R E -3.5104 Soluble
18 S E -2.7961 Soluble
19 L E -1.8530 Soluble
20 R E -2.3089 Soluble
21 L E 0.0000 Buried
22 S E -0.5050 Soluble
23 C E 0.0000 Buried
24 A E -0.2319 Soluble
25 A E -0.4384 Soluble
26 S E -0.6312 Soluble
27 G E -0.8586 Soluble
28 F E -0.3288 Soluble
29 T E -0.2639 Soluble
30 F E 0.0000 Buried
35 S E -0.7306 Soluble
36 S E -0.2430 Soluble
37 Y E -0.2253 Soluble
38 G E 0.0000 Buried
39 M E 0.0000 Buried
40 H E 0.0000 Buried
41 W E 0.0000 Buried
42 V E 0.0000 Buried
43 R E 0.0000 Buried
44 Q E -0.9794 Soluble
45 A E -1.2567 Soluble
46 P E -0.9566 Soluble
47 G E -1.4907 Soluble
48 K E -2.2792 Soluble
49 G E -1.4349 Soluble
50 L E 0.0000 Buried
51 E E -1.0408 Soluble
52 W E 0.0000 Buried
53 V E 0.0000 Buried
54 A E 0.0000 Buried
55 V E 0.0000 Buried
56 M E 0.0000 Buried
57 W E 0.0000 Buried
58 Y E -0.5051 Soluble
59 D E -1.9474 Soluble
62 G E -1.8024 Soluble
63 S E -1.6055 Soluble
64 N E -2.0904 Soluble
65 K E -1.7203 Soluble
66 D E -1.6098 Soluble
67 Y E -1.4773 Soluble
68 V E -1.4634 Soluble
69 D E -2.5168 Soluble
70 S E -1.8015 Soluble
71 V E 0.0000 Buried
72 K E -2.6972 Soluble
74 G E -2.0426 Soluble
75 R E -2.1760 Soluble
76 F E 0.0000 Buried
77 T E -1.1921 Soluble
78 I E 0.0000 Buried
79 S E -0.7459 Soluble
80 R E 0.0000 Buried
81 D E -1.8310 Soluble
82 N E -1.9068 Soluble
83 S E -1.8103 Soluble
84 K E -2.5759 Soluble
85 N E -2.0136 Soluble
86 T E 0.0000 Buried
87 L E 0.0000 Buried
88 Y E 0.0000 Buried
89 L E 0.0000 Buried
90 Q E -1.7377 Soluble
91 M E 0.0000 Buried
92 N E -3.1235 Soluble
93 R E -3.7141 Soluble
94 L E 0.0000 Buried
95 R E -3.4965 Soluble
96 A E -1.9306 Soluble
97 E E -2.3678 Soluble
98 D E 0.0000 Buried
99 T E -0.8448 Soluble
100 A E 0.0000 Buried
101 V E 0.1572 Aggregation-prone
102 Y E 0.0000 Buried
103 Y E 0.0000 Buried
104 C E 0.0000 Buried
105 A E 0.0000 Buried
106 R E -0.3461 Soluble
107 E E 0.0000 Buried
108 K E -0.9187 Soluble
109 D E -0.5867 Soluble
110 H E -0.2455 Soluble
111 Y E 1.3635 Aggregation-prone
111A D E 1.4972 Aggregation-prone
111B I E 2.7474 Aggregation-prone
111C L E 2.6020 Aggregation-prone
111D T E 1.4804 Aggregation-prone
112D G E 1.2293 Aggregation-prone
112C Y E 1.4759 Aggregation-prone
112B N E 0.3526 Aggregation-prone
112A Y E 0.2660 Aggregation-prone
112 Y E 0.2536 Aggregation-prone
113 Y E 0.3149 Aggregation-prone
114 G E 0.0000 Buried
115 L E 0.0000 Buried
116 D E -0.6267 Soluble
117 V E -0.3927 Soluble
118 W E 0.0000 Buried
119 G E 0.0000 Buried
120 Q E -1.3548 Soluble
121 G E -0.6810 Soluble
122 T E -0.2449 Soluble
123 T E -0.0205 Soluble
124 V E 0.0000 Buried
125 T E -0.4835 Soluble
126 V E 0.0000 Buried
127 S E -0.7312 Soluble
128 S E -0.5909 Soluble
129 A E -0.4905 Soluble
130 S E -0.6479 Soluble
131 T E -0.9730 Soluble
132 K E -1.6891 Soluble
133 G E -1.6157 Soluble
134 P E 0.0000 Buried
135 S E -0.2841 Soluble
136 V E 0.0000 Buried
137 F E -0.5921 Soluble
138 P E -1.0639 Soluble
139 L E 0.0000 Buried
140 A E -1.2324 Soluble
141 P E 0.0000 Buried
142 S E -1.2839 Soluble
143 S E -1.5083 Soluble
144 K E -2.1254 Soluble
145 S E -1.3803 Soluble
146 T E -0.8893 Soluble
147 S E -0.9273 Soluble
148 G E -1.1454 Soluble
149 G E -0.9244 Soluble
150 T E -0.5518 Soluble
151 A E -0.3036 Soluble
152 A E 0.0000 Buried
153 L E 0.0000 Buried
154 G E 0.0000 Buried
155 C E 0.0000 Buried
156 L E 0.0000 Buried
157 V E 0.0000 Buried
158 K E 0.0000 Buried
159 D E -0.5026 Soluble
160 Y E 0.0000 Buried
161 F E 0.0000 Buried
162 P E -0.9383 Soluble
163 E E -1.1769 Soluble
164 P E -1.1583 Soluble
165 V E -0.9287 Soluble
166 T E -0.7124 Soluble
167 V E -0.0015 Soluble
168 S E -0.4165 Soluble
169 W E 0.0000 Buried
170 N E -0.8674 Soluble
171 S E -0.6757 Soluble
172 G E -0.5612 Soluble
173 A E -0.2330 Soluble
174 L E 0.0439 Aggregation-prone
175 T E -0.1289 Soluble
176 S E -0.1074 Soluble
177 G E -0.0731 Soluble
178 V E 0.2461 Aggregation-prone
179 H E -0.3056 Soluble
180 T E 0.0362 Aggregation-prone
181 F E 0.0000 Buried
182 P E -0.3397 Soluble
183 A E 0.0589 Aggregation-prone
184 V E 0.3159 Aggregation-prone
185 L E 1.0591 Aggregation-prone
186 Q E 0.2018 Aggregation-prone
187 S E -0.1735 Soluble
188 S E -0.1797 Soluble
189 G E 0.0261 Aggregation-prone
190 L E -0.0145 Soluble
191 Y E 0.2172 Aggregation-prone
192 S E 0.0000 Buried
193 L E 0.0000 Buried
194 S E 0.0000 Buried
195 S E 0.0000 Buried
196 V E 0.0000 Buried
197 V E 0.0000 Buried
198 T E -0.0924 Soluble
199 V E 0.0000 Buried
200 P E -0.4638 Soluble
201 S E -0.6108 Soluble
202 S E -0.6913 Soluble
203 S E -0.6430 Soluble
204 L E -0.7217 Soluble
205 G E -0.9980 Soluble
206 T E -0.7762 Soluble
207 Q E -1.1848 Soluble
208 T E -1.2254 Soluble
209 Y E 0.0000 Buried
210 I E -1.3965 Soluble
211 C E 0.0000 Buried
212 N E -1.5288 Soluble
213 V E 0.0000 Buried
214 N E -2.1300 Soluble
215 H E 0.0000 Buried
216 K E -2.8810 Soluble
217 P E -1.8575 Soluble
218 S E -2.0873 Soluble
219 N E -2.6792 Soluble
220 T E -2.1869 Soluble
221 K E -2.7537 Soluble
222 V E -1.5595 Soluble
223 D E -2.6804 Soluble
224 K E -2.1554 Soluble
225 K E -2.6814 Soluble
226 V E 0.0000 Buried
227 E E -2.7759 Soluble
228 P E -1.9871 Soluble
229 K E -2.4487 Soluble
230 S E -1.2157 Soluble
231 C E -0.4317 Soluble
1 D D -2.5601 Soluble
2 I D 0.0000 Buried
3 Q D -2.2454 Soluble
4 M D 0.0000 Buried
5 T D -1.3208 Soluble
6 Q D 0.0000 Buried
7 S D -0.5743 Soluble
8 P D -0.4807 Soluble
9 S D -0.6647 Soluble
10 S D -0.6359 Soluble
11 L D -0.4132 Soluble
12 S D -0.7209 Soluble
13 A D 0.0000 Buried
14 S D -0.7156 Soluble
15 V D 0.1736 Aggregation-prone
16 G D -0.8322 Soluble
17 D D -1.7288 Soluble
18 R D -2.3074 Soluble
19 V D 0.0000 Buried
20 T D -0.6253 Soluble
21 I D 0.0000 Buried
22 T D -0.8741 Soluble
23 C D 0.0000 Buried
24 R D -2.8375 Soluble
25 A D 0.0000 Buried
26 S D -2.1914 Soluble
27 Q D -2.7065 Soluble
28 G D -2.3153 Soluble
29 I D 0.0000 Buried
36 R D -2.8535 Soluble
37 N D -1.9260 Soluble
38 D D -0.9888 Soluble
39 L D 0.0000 Buried
40 G D 0.0000 Buried
41 W D 0.0000 Buried
42 Y D 0.0000 Buried
43 Q D 0.0000 Buried
44 Q D -1.6173 Soluble
45 K D -2.1199 Soluble
46 P D -1.6703 Soluble
47 G D -1.7899 Soluble
48 K D -2.7864 Soluble
49 A D -1.8513 Soluble
50 P D 0.0000 Buried
51 K D -2.1200 Soluble
52 R D 0.0000 Buried
53 L D 0.0000 Buried
54 I D 0.0000 Buried
55 Y D 0.4142 Aggregation-prone
56 A D -0.2190 Soluble
57 A D 0.0000 Buried
65 S D -0.2817 Soluble
66 S D 0.0958 Aggregation-prone
67 L D 0.2132 Aggregation-prone
68 E D -0.4695 Soluble
69 S D -0.4728 Soluble
70 G D -0.5492 Soluble
71 V D -0.2434 Soluble
72 P D -0.3513 Soluble
74 S D -0.4278 Soluble
75 R D -0.7684 Soluble
76 F D 0.0000 Buried
77 S D -0.2829 Soluble
78 G D -0.1856 Soluble
79 S D -0.7653 Soluble
80 G D -1.4827 Soluble
83 S D -1.7424 Soluble
84 G D -2.3340 Soluble
85 T D -2.4115 Soluble
86 E D -2.9537 Soluble
87 F D 0.0000 Buried
88 T D -0.8300 Soluble
89 L D 0.0000 Buried
90 T D -0.6150 Soluble
91 I D 0.0000 Buried
92 S D -1.3285 Soluble
93 S D -1.2626 Soluble
94 V D 0.0000 Buried
95 Q D -0.8934 Soluble
96 P D -0.8678 Soluble
97 E D -1.7314 Soluble
98 D D 0.0000 Buried
99 F D -0.4882 Soluble
100 V D 0.0000 Buried
101 T D -0.7784 Soluble
102 Y D 0.0000 Buried
103 Y D 0.0000 Buried
104 C D 0.0000 Buried
105 L D 0.0000 Buried
106 Q D 0.0000 Buried
107 H D -0.4937 Soluble
108 N D -1.3318 Soluble
109 S D -1.4082 Soluble
114 N D -1.8302 Soluble
115 P D -1.6345 Soluble
116 L D 0.0000 Buried
117 T D -0.9951 Soluble
118 F D -0.3492 Soluble
119 G D 0.0000 Buried
120 G D -1.0190 Soluble
121 G D 0.0000 Buried
122 T D 0.0000 Buried
123 K D -1.1633 Soluble
124 V D 0.0000 Buried
125 E D -1.0497 Soluble
126 I D -0.6208 Soluble
127 K D -1.4224 Soluble
128 R D -0.9826 Soluble
129 T D -0.0059 Soluble
130 V D 0.6776 Aggregation-prone
131 A D 0.2713 Aggregation-prone
132 A D -0.0855 Soluble
133 P D 0.0000 Buried
134 S D -0.1189 Soluble
135 V D 0.0000 Buried
136 F D 0.1041 Aggregation-prone
137 I D 0.0273 Aggregation-prone
138 F D 0.0000 Buried
139 P D -0.6034 Soluble
140 P D 0.0000 Buried
141 S D -1.6606 Soluble
142 D D -2.7347 Soluble
143 E D -2.3900 Soluble
144 Q D 0.0000 Buried
145 L D -2.0748 Soluble
146 K D -2.6660 Soluble
147 S D -1.6282 Soluble
148 G D -1.0062 Soluble
149 T D -0.7900 Soluble
150 A D 0.0000 Buried
151 S D 0.0000 Buried
152 V D 0.0000 Buried
153 V D 0.0000 Buried
154 C D 0.0000 Buried
155 L D 0.0000 Buried
156 L D 0.0000 Buried
157 N D 0.0000 Buried
158 N D -0.6970 Soluble
159 F D 0.0000 Buried
160 Y D 0.0000 Buried
161 P D -1.1481 Soluble
162 R D -1.9163 Soluble
163 E D -2.6751 Soluble
164 A D -2.0049 Soluble
165 K D -2.2099 Soluble
166 V D -0.8862 Soluble
167 Q D -0.4590 Soluble
168 W D 0.0000 Buried
169 K D -0.3873 Soluble
170 V D 0.0000 Buried
171 D D -1.8323 Soluble
172 N D -1.4223 Soluble
173 A D -0.1887 Soluble
174 L D 0.8021 Aggregation-prone
175 Q D -0.0148 Soluble
176 S D -0.4937 Soluble
177 G D -0.9568 Soluble
178 N D -0.9426 Soluble
179 S D -1.2924 Soluble
180 Q D -1.7495 Soluble
181 E D -2.0777 Soluble
182 S D -0.9245 Soluble
183 V D -0.6764 Soluble
184 T D -1.0864 Soluble
185 E D -2.2317 Soluble
186 Q D -1.8757 Soluble
187 D D -2.1220 Soluble
188 S D -1.8107 Soluble
189 K D -2.3436 Soluble
190 D D -1.7986 Soluble
191 S D -1.8200 Soluble
192 T D 0.0000 Buried
193 Y D 0.0000 Buried
194 S D 0.0000 Buried
195 L D 0.0000 Buried
196 S D 0.0000 Buried
197 S D 0.0000 Buried
198 T D -0.7637 Soluble
199 L D 0.0000 Buried
200 T D -0.3457 Soluble
201 L D -0.5743 Soluble
202 S D -1.1510 Soluble
203 K D -1.9329 Soluble
204 A D -1.9389 Soluble
205 D D -2.6610 Soluble
206 Y D 0.0000 Buried
207 E D -3.3861 Soluble
208 K D -3.6142 Soluble
209 H D -3.1398 Soluble
210 K D -3.3113 Soluble
211 V D -1.7439 Soluble
212 Y D 0.0000 Buried
213 A D -0.6708 Soluble
214 C D 0.0000 Buried
215 E D -0.6689 Soluble
216 V D 0.0000 Buried
217 T D -1.1504 Soluble
218 H D 0.0000 Buried
219 Q D -1.6174 Soluble
220 G D -0.3859 Soluble
221 L D -0.2295 Soluble
222 S D -0.4866 Soluble
223 S D -0.3751 Soluble
224 P D -0.4477 Soluble
225 V D 0.0428 Aggregation-prone
226 T D -0.4459 Soluble
227 K D -0.7739 Soluble
228 S D -0.7432 Soluble
229 F D 0.0000 Buried
230 N D -1.8844 Soluble
231 R D -2.2506 Soluble
232 G D -1.2480 Soluble
233 E D -1.4068 Soluble
234 C D -1.1086 Soluble

3D Structure — colored by A4D score

Sequence - click residue to focus in viewer  |  colored by A4D score
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Downloads
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 -0.8596 4.0404 CSV PDB
4.5 -0.9007 3.9889 CSV PDB
5.0 -0.9481 3.9368 CSV PDB
5.5 -0.9914 3.8915 CSV PDB
6.0 -1.0184 3.8566 CSV PDB
6.5 -1.0204 3.8255 CSV PDB
7.0 -0.9989 3.7871 CSV PDB
7.5 -0.9625 3.7394 CSV PDB
8.0 -0.9178 3.6895 CSV PDB
8.5 -0.867 3.6467 CSV PDB
9.0 -0.8102 3.6184 CSV PDB
Average A4D Score vs pH
Max A4D Score vs pH