Lanadelumab / 4pub

A4DAB151_4pub_H_L | Source PDB: 4pub | Chains: H, L | Done
100
Yes
10 Å
Yes
Avg A4D Score
-0.6746
Max Score
2.0049
Min Score
-3.5513
Total Score
-285.38
Score CDR
-0.3266
Score non-CDR
-0.7635

Calculation Parameters

Chain Sequence(s) VQLLESGGGLVQPGGSLRLSCAASGHYIMMWVRQAPGKGLEWVSGIYGGITVYADSVKGRFTISRDNSKNTLYLQMNSLRAEDTAVYYCAYRRIRDEFDIWGQGTMVTVSSASTKGPSVFPLAPSSKSTSGGTAALGCLVKDYFPEPVTVSWNSGALTSGVHTFPAVLQSSGLYSLSSVVTVPSSSLGTQTYICNVNHKPSNTKVDKRVEPKDIQMTQSPSTLSASVGDRVTITCRASQSISSWLAWYQQKPGKAPKLLIYKASTLESGVPSRFSGSGSGTEFTLTISSLQPDDFATYYCQQYNTYWTFGQGTKVEIKRTVAAPSVFIFPPSDEQLKSGTASVVCLLNNFYPREAKVQWKVDNALQSGNSQESVTEQDSKDSTYSLSSTLTLSKADYEKHKVYACEVTHQGLSSPVTKSFNRGE 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 -3.5513
Maximum Score 2.0049
Average Score -0.6746
Total Score -285.3757

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

Index Residue Chain A4D Score Classification
2 V H 1.0576 Aggregation-prone
3 Q H 0.2042 Aggregation-prone
4 L H 0.0000 Buried
5 L H 1.1138 Aggregation-prone
6 E H -0.0333 Soluble
7 S H -0.5246 Soluble
8 G H -1.0116 Soluble
9 G H -0.2858 Soluble
11 G H 0.2626 Aggregation-prone
12 L H 0.9117 Aggregation-prone
13 V H -0.2372 Soluble
14 Q H -1.4543 Soluble
15 P H -1.7252 Soluble
16 G H -1.5079 Soluble
17 G H -1.0605 Soluble
18 S H -1.2109 Soluble
19 L H -0.9799 Soluble
20 R H -2.1154 Soluble
21 L H 0.0000 Buried
22 S H -0.6484 Soluble
23 C H 0.0000 Buried
24 A H -0.5286 Soluble
25 A H -0.1744 Soluble
27 G H 0.0707 Aggregation-prone
28 H H 0.0047 Aggregation-prone
37 Y H 1.0001 Aggregation-prone
38 I H 1.1423 Aggregation-prone
39 M H 0.0000 Buried
40 M 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 -0.7619 Soluble
45 A H -1.1640 Soluble
46 P H -1.0029 Soluble
47 G H -1.5009 Soluble
48 K H -2.3487 Soluble
49 G H -1.6023 Soluble
50 L H 0.0000 Buried
51 E H -1.0749 Soluble
52 W H 0.0000 Buried
53 V H 0.0000 Buried
54 S H 0.0000 Buried
55 G H 0.0000 Buried
56 I H 0.0000 Buried
57 Y H 1.5693 Aggregation-prone
58 G H 0.1717 Aggregation-prone
63 G H 0.5522 Aggregation-prone
64 I H 2.0049 Aggregation-prone
65 T H 1.0800 Aggregation-prone
66 V H 0.4950 Aggregation-prone
67 Y H -0.6666 Soluble
68 A H -1.4249 Soluble
69 D H -2.5895 Soluble
70 S H -1.7154 Soluble
71 V H 0.0000 Buried
72 K H -2.5360 Soluble
74 G H -1.7513 Soluble
75 R H -1.3283 Soluble
76 F H 0.0000 Buried
77 T H -0.8547 Soluble
78 I H 0.0000 Buried
79 S H -0.9761 Soluble
80 R H -2.7033 Soluble
81 D H -2.9615 Soluble
82 N H -3.1115 Soluble
83 S H -2.4108 Soluble
84 K H -3.2028 Soluble
85 N H -2.9680 Soluble
86 T H 0.0000 Buried
87 L H 0.0000 Buried
88 Y H 0.0000 Buried
89 L H 0.0000 Buried
90 Q H -1.3318 Soluble
91 M H 0.0000 Buried
92 N H -1.6203 Soluble
93 S H -1.3722 Soluble
94 L H 0.0000 Buried
95 R H -2.3713 Soluble
96 A H -1.7535 Soluble
97 E H -2.2652 Soluble
98 D H 0.0000 Buried
99 T H -0.5627 Soluble
100 A H 0.0000 Buried
101 V H 0.1630 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 Y H 0.0000 Buried
107 R H 0.0000 Buried
108 R H -0.1650 Soluble
109 I H 1.7327 Aggregation-prone
110 R H -2.6998 Soluble
113 D H -3.0518 Soluble
114 E H -1.8175 Soluble
115 F H -0.6216 Soluble
116 D H 0.0000 Buried
117 I H 0.1482 Aggregation-prone
118 W H -0.0083 Soluble
119 G H 0.0000 Buried
120 Q H -1.4021 Soluble
121 G H -0.6579 Soluble
122 T H -0.0077 Soluble
123 M H 0.5548 Aggregation-prone
124 V H 0.0000 Buried
125 T H 0.0007 Aggregation-prone
126 V H 0.0000 Buried
127 S H -0.8202 Soluble
128 S H -0.6636 Soluble
129 A H -0.4109 Soluble
130 S H -0.5379 Soluble
131 T H -0.7723 Soluble
132 K H -1.2261 Soluble
133 G H -1.4016 Soluble
134 P H -0.5928 Soluble
135 S H -0.2729 Soluble
136 V H 0.0000 Buried
137 F H 0.0000 Buried
138 P H -1.0535 Soluble
139 L H 0.0000 Buried
140 A H -1.2506 Soluble
141 P H 0.0000 Buried
142 S H -1.2161 Soluble
143 S H -0.9027 Soluble
144 K H -1.2181 Soluble
145 S H 0.0000 Buried
146 T H -0.6744 Soluble
147 S H -0.7381 Soluble
148 G H -0.8294 Soluble
149 G H -0.8921 Soluble
150 T H -0.6003 Soluble
151 A H 0.0000 Buried
152 A H 0.0000 Buried
153 L H 0.0000 Buried
154 G H 0.0000 Buried
155 C H 0.0000 Buried
156 L H 0.0000 Buried
157 V H 0.0000 Buried
158 K H 0.0000 Buried
159 D H -0.3407 Soluble
160 Y H 0.0000 Buried
161 F H 0.0000 Buried
162 P H -0.8449 Soluble
163 E H -1.0791 Soluble
164 P H -1.1285 Soluble
165 V H -0.8757 Soluble
166 T H -0.6935 Soluble
167 V H -0.4304 Soluble
168 S H -0.4669 Soluble
169 W H 0.0000 Buried
170 N H -0.7843 Soluble
171 S H -0.7026 Soluble
172 G H -0.5733 Soluble
173 A H -0.2428 Soluble
174 L H -0.0243 Soluble
175 T H -0.1822 Soluble
176 S H -0.1891 Soluble
177 G H -0.2356 Soluble
178 V H 0.1498 Aggregation-prone
179 H H -0.3118 Soluble
180 T H 0.0404 Aggregation-prone
181 F H 0.0000 Buried
182 P H -0.2690 Soluble
183 A H 0.2049 Aggregation-prone
184 V H 0.6598 Aggregation-prone
185 L H 1.4118 Aggregation-prone
186 Q H 0.4958 Aggregation-prone
187 S H 0.0355 Aggregation-prone
188 S H -0.1204 Soluble
189 G H 0.1399 Aggregation-prone
190 L H 0.1520 Aggregation-prone
191 Y H 0.4082 Aggregation-prone
192 S H 0.0000 Buried
193 L H 0.0000 Buried
194 S H 0.0000 Buried
195 S H 0.0000 Buried
196 V H 0.0000 Buried
197 V H 0.0000 Buried
198 T H -0.1295 Soluble
199 V H 0.0000 Buried
200 P H -0.6209 Soluble
201 S H -0.5855 Soluble
202 S H -0.5825 Soluble
203 S H -0.6106 Soluble
204 L H -0.8837 Soluble
205 G H -0.9207 Soluble
206 T H -0.7109 Soluble
207 Q H -1.0594 Soluble
208 T H -1.1809 Soluble
209 Y H 0.0000 Buried
210 I H -1.3577 Soluble
211 C H 0.0000 Buried
212 N H -1.5955 Soluble
213 V H 0.0000 Buried
214 N H -2.0785 Soluble
215 H H 0.0000 Buried
216 K H -2.8303 Soluble
217 P H -1.7504 Soluble
218 S H -1.8792 Soluble
219 N H -2.5557 Soluble
220 T H -2.1120 Soluble
221 K H -2.7033 Soluble
222 V H -1.6138 Soluble
223 D H -2.5959 Soluble
224 K H -2.1114 Soluble
225 R H -2.8195 Soluble
226 V H 0.0000 Buried
227 E H -2.7782 Soluble
228 P H -2.0523 Soluble
229 K H -2.2525 Soluble
1 D L -2.3658 Soluble
2 I L -1.5844 Soluble
3 Q L -2.2055 Soluble
4 M L 0.0000 Buried
5 T L -1.4059 Soluble
6 Q L 0.0000 Buried
7 S L -0.7266 Soluble
8 P L -0.4349 Soluble
9 S L -0.6566 Soluble
10 T L -0.4297 Soluble
11 L L -0.2881 Soluble
12 S L -0.6194 Soluble
13 A L 0.0000 Buried
14 S L -0.2246 Soluble
15 V L 0.5874 Aggregation-prone
16 G L -0.5424 Soluble
17 D L -1.3212 Soluble
18 R L -2.1290 Soluble
19 V L 0.0000 Buried
20 T L -0.5770 Soluble
21 I L 0.0000 Buried
22 T L -0.8730 Soluble
23 C L 0.0000 Buried
24 R L -2.8127 Soluble
25 A L 0.0000 Buried
26 S L -1.9016 Soluble
27 Q L -2.1319 Soluble
28 S L -1.3895 Soluble
29 I L 0.0000 Buried
36 S L -0.8608 Soluble
37 S L -0.7382 Soluble
38 W L -0.2592 Soluble
39 L L 0.0000 Buried
40 A L 0.0000 Buried
41 W L 0.0000 Buried
42 Y L 0.0000 Buried
43 Q L -0.8609 Soluble
44 Q L 0.0000 Buried
45 K L -1.6338 Soluble
46 P L -1.4509 Soluble
47 G L -1.6363 Soluble
48 K L -2.5410 Soluble
49 A L -1.6663 Soluble
50 P L 0.0000 Buried
51 K L -1.4888 Soluble
52 L L 0.0000 Buried
53 L L 0.0000 Buried
54 I L 0.0000 Buried
55 Y L -0.1947 Soluble
56 K L -1.0123 Soluble
57 A L 0.0000 Buried
65 S L -0.5509 Soluble
66 T L -0.1861 Soluble
67 L L 0.2393 Aggregation-prone
68 E L 0.0000 Buried
69 S L -1.0018 Soluble
70 G L -0.7493 Soluble
71 V L 0.0000 Buried
72 P L -0.3742 Soluble
74 S L -0.4341 Soluble
75 R L -0.8045 Soluble
76 F L 0.0000 Buried
77 S L -0.3554 Soluble
78 G L -0.4766 Soluble
79 S L -0.8571 Soluble
80 G L -1.2680 Soluble
83 S L -1.2160 Soluble
84 G L -1.1902 Soluble
85 T L -1.8189 Soluble
86 E L -2.2727 Soluble
87 F L 0.0000 Buried
88 T L -0.7986 Soluble
89 L L 0.0000 Buried
90 T L -0.6265 Soluble
91 I L 0.0000 Buried
92 S L -1.3049 Soluble
93 S L -1.0253 Soluble
94 L L 0.0000 Buried
95 Q L -0.8660 Soluble
96 P L -0.8564 Soluble
97 D L -1.8655 Soluble
98 D L 0.0000 Buried
99 F L -0.2921 Soluble
100 A L 0.0000 Buried
101 T L -0.5799 Soluble
102 Y L 0.0000 Buried
103 Y L 0.0000 Buried
104 C L 0.0000 Buried
105 Q L 0.0000 Buried
106 Q L 0.0000 Buried
107 Y L 0.0319 Aggregation-prone
108 N L -0.4702 Soluble
114 T L -0.1340 Soluble
115 Y L 0.7512 Aggregation-prone
116 W L 0.0000 Buried
117 T L -0.5793 Soluble
118 F L 0.0000 Buried
119 G L 0.0000 Buried
120 Q L -1.5634 Soluble
121 G L 0.0000 Buried
122 T L 0.0000 Buried
123 K L -0.8352 Soluble
124 V L 0.0000 Buried
125 E L 0.0000 Buried
126 I L -0.2071 Soluble
127 K L -1.1976 Soluble
128 R L -1.0383 Soluble
129 T L -0.1095 Soluble
130 V L 0.5755 Aggregation-prone
131 A L 0.1334 Aggregation-prone
132 A L -0.1000 Soluble
133 P L 0.0000 Buried
134 S L -0.2505 Soluble
135 V L 0.0000 Buried
136 F L 0.0000 Buried
137 I L 0.0000 Buried
138 F L 0.0000 Buried
139 P L -0.6872 Soluble
140 P L -0.8499 Soluble
141 S L -1.4638 Soluble
142 D L -2.7156 Soluble
143 E L -2.4170 Soluble
144 Q L 0.0000 Buried
145 L L -2.0517 Soluble
146 K L -2.6162 Soluble
147 S L -1.6205 Soluble
148 G L -1.1813 Soluble
149 T L -1.0431 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 -0.8512 Soluble
159 F L 0.0000 Buried
160 Y L 0.0000 Buried
161 P L -1.1586 Soluble
162 R L -1.8298 Soluble
163 E L -2.6531 Soluble
164 A L -2.0506 Soluble
165 K L -2.2476 Soluble
166 V L -1.1911 Soluble
167 Q L -0.8126 Soluble
168 W L 0.0000 Buried
169 K L -0.5234 Soluble
170 V L 0.0000 Buried
171 D L -1.7607 Soluble
172 N L -1.4669 Soluble
173 A L -0.2575 Soluble
174 L L 0.6021 Aggregation-prone
175 Q L -0.1666 Soluble
176 S L -0.4608 Soluble
177 G L -0.8330 Soluble
178 N L -0.7012 Soluble
179 S L -0.9289 Soluble
180 Q L -0.9471 Soluble
181 E L -1.4614 Soluble
182 S L -0.5260 Soluble
183 V L -0.3403 Soluble
184 T L -0.9637 Soluble
185 E L -2.0949 Soluble
186 Q L -1.7017 Soluble
187 D L -1.9783 Soluble
188 S L -1.6896 Soluble
189 K L -2.2274 Soluble
190 D L -1.6394 Soluble
191 S L -1.6601 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 -0.5154 Soluble
199 L L 0.0000 Buried
200 T L -0.4260 Soluble
201 L L -0.7875 Soluble
202 S L -1.2123 Soluble
203 K L -2.1648 Soluble
204 A L -2.0416 Soluble
205 D L -2.9645 Soluble
206 Y L 0.0000 Buried
207 E L -3.3299 Soluble
208 K L -3.5513 Soluble
209 H L -2.8063 Soluble
210 K L -3.1367 Soluble
211 V L -1.4098 Soluble
212 Y L 0.0000 Buried
213 A L 0.0000 Buried
214 C L 0.0000 Buried
215 E L -0.7608 Soluble
216 V L 0.0000 Buried
217 T L -1.2669 Soluble
218 H L 0.0000 Buried
219 Q L -1.4482 Soluble
220 G L -0.4223 Soluble
221 L L -0.2416 Soluble
222 S L -0.4728 Soluble
223 S L -0.4386 Soluble
224 P L -0.5473 Soluble
225 V L 0.0003 Aggregation-prone
226 T L -0.4484 Soluble
227 K L -0.7875 Soluble
228 S L -0.7665 Soluble
229 F L 0.0000 Buried
230 N L -2.0045 Soluble
231 R L -2.5624 Soluble
232 G L -2.3536 Soluble
233 E L -2.5762 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 -0.7174 3.128 CSV PDB
4.5 -0.7589 3.128 CSV PDB
5.0 -0.8062 3.128 CSV PDB
5.5 -0.8501 3.128 CSV PDB
6.0 -0.8802 3.128 CSV PDB
6.5 -0.8887 3.128 CSV PDB
7.0 -0.876 3.128 CSV PDB
7.5 -0.8492 3.128 CSV PDB
8.0 -0.8142 3.128 CSV PDB
8.5 -0.7724 3.1278 CSV PDB
9.0 -0.7236 3.1273 CSV PDB
Average A4D Score vs pH
Max A4D Score vs pH