Teropavimab / 4lsv

A4DAB261_4lsv_H_L | Source PDB: 4lsv | Chains: H, L | Done
99.55
Yes
10 Å
Yes
Avg A4D Score
-0.7843
Max Score
1.234
Min Score
-3.6954
Total Score
-332.54
Score CDR
-0.7523
Score non-CDR
-0.7875

Calculation Parameters

Chain Sequence(s) QVQLLQSGAAVTKPGASVRVSCEASGYNIRDYFIHWWRQAPGQGLQWVGWINPKTGQPNNPRQFQGRVSLTRHASWDFDTYSFYMDLKALRSDDTAVYFCARQRSDYWDFDVWGSGTQVTVSSASTKGPSVFPLAPSSKSTSTAALGCLVKDYFPEPVTVSWNSGALTSGVHTFPAVLQSSGLYSLSSVVTVPSSSLGTQTYICNVNHKPSNTKVDKKVEPDIQMTQSPSSLSASVGDTVTITCQANGYLNWYQQRRGKAPKLLIYDGSKLERGVPSRFSGRRWGQEYNLTINNLQPEDIATYFCQVYEFVVPGTRLDLKRTVAAPSVFIFPPSDEQLKSGTASVVCLLNNFYPREAKVQWKVDNALQSGNSQESVTEQDSKDSTYSLSSTLTLSKADYEKHKVYACEVTHQGLSSPVTKSFNR 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 -3.6954
Maximum Score 1.234
Average Score -0.7843
Total Score -332.5358

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

Index Residue Chain A4D Score Classification
1 Q H -1.3433 Soluble
2 V H -0.8386 Soluble
3 Q H -1.2314 Soluble
4 L H 0.0000 Buried
5 L H 0.0257 Aggregation-prone
6 Q H -0.2993 Soluble
7 S H -0.5956 Soluble
8 G H -0.3927 Soluble
9 A H 0.0050 Aggregation-prone
11 A H 0.4619 Aggregation-prone
12 V H 1.2340 Aggregation-prone
13 T H -0.4174 Soluble
14 K H -1.8635 Soluble
15 P H -1.8623 Soluble
16 G H -1.7131 Soluble
17 A H -1.3519 Soluble
18 S H -1.5675 Soluble
19 V H -0.9133 Soluble
20 R H -1.5513 Soluble
21 V H 0.0000 Buried
22 S H -0.5817 Soluble
23 C H 0.0000 Buried
24 E H -0.8673 Soluble
25 A H 0.0000 Buried
26 S H -1.1988 Soluble
27 G H -1.3785 Soluble
28 Y H -1.4611 Soluble
29 N H -2.0720 Soluble
30 I H 0.0000 Buried
35 R H -2.5230 Soluble
36 D H -2.7248 Soluble
37 Y H -1.3833 Soluble
38 F H -0.2722 Soluble
39 I H 0.0000 Buried
40 H H 0.0000 Buried
41 W H 0.0000 Buried
42 W H 0.0000 Buried
43 R H 0.0000 Buried
44 Q H -0.6861 Soluble
45 A H -0.9716 Soluble
46 P H -0.7576 Soluble
47 G H -1.5433 Soluble
48 Q H -1.7171 Soluble
49 G H -0.9574 Soluble
50 L H 0.0000 Buried
51 Q H -0.4454 Soluble
52 W H 0.0000 Buried
53 V H 0.0000 Buried
54 G H 0.0000 Buried
55 W H -0.1447 Soluble
56 I H 0.0000 Buried
57 N H -1.4896 Soluble
58 P H 0.0000 Buried
59 K H -2.6987 Soluble
62 T H -1.6285 Soluble
63 G H -1.5183 Soluble
64 Q H -1.6872 Soluble
65 P H -1.0204 Soluble
66 N H -1.1912 Soluble
67 N H -1.4460 Soluble
68 P H -1.8842 Soluble
69 R H -3.0663 Soluble
70 Q H -2.5657 Soluble
71 F H 0.0000 Buried
72 Q H -2.6584 Soluble
74 G H -1.9202 Soluble
75 R H -1.8125 Soluble
76 V H 0.0000 Buried
77 S H -1.0122 Soluble
78 L H 0.0000 Buried
79 T H -0.8002 Soluble
80 R H -1.5319 Soluble
81 H H -1.4386 Soluble
82 A H -1.0072 Soluble
83 S H -0.3421 Soluble
84 W H 0.1939 Aggregation-prone
85 D H -1.3987 Soluble
85A F H -0.9643 Soluble
85B D H -1.9658 Soluble
85C T H -1.1121 Soluble
85D Y H 0.0000 Buried
86 S H -0.7445 Soluble
87 F H 0.0000 Buried
88 Y H -0.6775 Soluble
89 M H 0.0000 Buried
90 D H -1.2039 Soluble
91 L H 0.0000 Buried
92 K H -2.1894 Soluble
93 A H -1.6643 Soluble
94 L H 0.0000 Buried
95 R H -3.0455 Soluble
96 S H -2.3503 Soluble
97 D H -2.4679 Soluble
98 D H 0.0000 Buried
99 T H -0.8342 Soluble
100 A H 0.0000 Buried
101 V H -0.2668 Soluble
102 Y H 0.0000 Buried
103 F H 0.0000 Buried
104 C H 0.0000 Buried
105 A H 0.0000 Buried
106 R H 0.0000 Buried
107 Q H -0.4862 Soluble
108 R H -0.8658 Soluble
109 S H -1.1601 Soluble
110 D H -1.5900 Soluble
112 Y H -0.3395 Soluble
113 W H 0.0000 Buried
114 D H 0.0000 Buried
115 F H 0.0000 Buried
116 D H -0.6459 Soluble
117 V H -0.2827 Soluble
118 W H -0.3634 Soluble
119 G H 0.0000 Buried
120 S H -0.7307 Soluble
121 G H -0.6087 Soluble
122 T H 0.0000 Buried
123 Q H -0.2570 Soluble
124 V H 0.0000 Buried
125 T H 0.0000 Buried
126 V H 0.0000 Buried
127 S H 0.0000 Buried
128 S H -0.7854 Soluble
129 A H -0.7884 Soluble
130 S H -0.5957 Soluble
131 T H -0.8202 Soluble
132 K H -1.5838 Soluble
133 G H -1.4947 Soluble
134 P H 0.0000 Buried
135 S H -0.3451 Soluble
136 V H 0.0000 Buried
137 F H -0.5793 Soluble
138 P H -1.0503 Soluble
139 L H 0.0000 Buried
140 A H -0.8338 Soluble
141 P H -0.9937 Soluble
142 S H -1.3843 Soluble
143 S H -1.3984 Soluble
144 K H -2.0740 Soluble
145 S H -1.2128 Soluble
146 T H -0.8196 Soluble
147 S H -0.7696 Soluble
148 T H -0.3289 Soluble
149 A H -0.4773 Soluble
150 A H 0.0000 Buried
151 L H 0.0000 Buried
152 G H 0.0000 Buried
153 C H 0.0000 Buried
154 L H 0.0000 Buried
155 V H 0.0000 Buried
156 K H 0.0000 Buried
157 D H -0.7118 Soluble
158 Y H 0.0000 Buried
159 F H 0.0000 Buried
160 P H -0.7900 Soluble
161 E H -1.1803 Soluble
162 P H -1.1040 Soluble
163 V H 0.0000 Buried
164 T H -0.6519 Soluble
165 V H -0.1825 Soluble
166 S H -0.3776 Soluble
167 W H 0.0000 Buried
168 N H -0.7942 Soluble
169 S H -0.6771 Soluble
170 G H -0.5153 Soluble
171 A H -0.2268 Soluble
172 L H 0.0755 Aggregation-prone
173 T H -0.1214 Soluble
174 S H -0.1979 Soluble
175 G H -0.2890 Soluble
176 V H 0.1314 Aggregation-prone
177 H H -0.3453 Soluble
178 T H -0.1748 Soluble
179 F H 0.0000 Buried
180 P H -0.2776 Soluble
181 A H 0.0667 Aggregation-prone
182 V H 0.4436 Aggregation-prone
183 L H 0.3623 Aggregation-prone
184 Q H -0.0625 Soluble
185 S H -0.5721 Soluble
186 S H -0.3801 Soluble
187 G H -0.4561 Soluble
188 L H -0.2460 Soluble
189 Y H 0.0461 Aggregation-prone
190 S H 0.0000 Buried
191 L H 0.0000 Buried
192 S H 0.0000 Buried
193 S H 0.0000 Buried
194 V H 0.0000 Buried
195 V H 0.0000 Buried
196 T H -0.1931 Soluble
197 V H 0.0000 Buried
198 P H -0.4107 Soluble
199 S H -0.6201 Soluble
200 S H -0.5359 Soluble
201 S H -0.5766 Soluble
202 L H -0.7992 Soluble
203 G H -1.0485 Soluble
204 T H -0.7252 Soluble
205 Q H -1.2374 Soluble
206 T H -1.0681 Soluble
207 Y H -0.9164 Soluble
208 I H -1.3035 Soluble
209 C H 0.0000 Buried
210 N H -1.4279 Soluble
211 V H 0.0000 Buried
212 N H -1.7698 Soluble
213 H H 0.0000 Buried
214 K H -2.8280 Soluble
215 P H -1.7718 Soluble
216 S H -1.8696 Soluble
217 N H -2.6195 Soluble
218 T H -2.0550 Soluble
219 K H -2.5307 Soluble
220 V H -1.3284 Soluble
221 D H -2.5073 Soluble
222 K H -1.8523 Soluble
223 K H -2.5506 Soluble
224 V H 0.0000 Buried
225 E H -2.4267 Soluble
226 P H -1.4691 Soluble
1 D L -1.9529 Soluble
2 I L -1.0593 Soluble
3 Q L -1.7230 Soluble
4 M L -1.1693 Soluble
5 T L -0.9068 Soluble
6 Q L -0.7861 Soluble
7 S L -0.5936 Soluble
8 P L -0.3814 Soluble
9 S L -0.5236 Soluble
10 S L -0.5118 Soluble
11 L L -0.2745 Soluble
12 S L -0.7711 Soluble
13 A L 0.0000 Buried
14 S L -0.5482 Soluble
15 V L 0.4717 Aggregation-prone
16 G L -0.9055 Soluble
17 D L -1.4755 Soluble
18 T L -1.3706 Soluble
19 V L 0.0000 Buried
20 T L -0.4111 Soluble
21 I L 0.0000 Buried
22 T L -0.9522 Soluble
23 C L 0.0000 Buried
24 Q L -2.5884 Soluble
25 A L 0.0000 Buried
27 N L -2.3519 Soluble
28 G L -0.6167 Soluble
38 Y L 0.4417 Aggregation-prone
39 L L 0.0000 Buried
40 N 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 -1.6778 Soluble
45 R L -2.6295 Soluble
46 R L -3.2139 Soluble
47 G L -2.5046 Soluble
48 K L -2.8901 Soluble
49 A L -1.5978 Soluble
50 P L 0.0000 Buried
51 K L -1.2617 Soluble
52 L L 0.0000 Buried
53 L L 0.0000 Buried
54 I L 0.0000 Buried
55 Y L 0.1507 Aggregation-prone
56 D L 0.0000 Buried
57 G L 0.0000 Buried
65 S L -1.3380 Soluble
66 K L -1.2711 Soluble
67 L L -0.3957 Soluble
68 E L 0.0000 Buried
69 R L -2.0443 Soluble
70 G L -1.2508 Soluble
71 V L -0.7824 Soluble
72 P L -0.5491 Soluble
74 S L -0.7489 Soluble
75 R L -1.2567 Soluble
76 F L 0.0000 Buried
77 S L -0.9194 Soluble
78 G L -1.5486 Soluble
79 R L -2.7858 Soluble
80 R L -2.6860 Soluble
83 W L -0.9025 Soluble
84 G L -1.5087 Soluble
85 Q L -2.6881 Soluble
86 E L -2.8024 Soluble
87 Y L 0.0000 Buried
88 N L -1.5478 Soluble
89 L L 0.0000 Buried
90 T L 0.0000 Buried
91 I L 0.0000 Buried
92 N L -2.3198 Soluble
93 N L -2.1659 Soluble
94 L L 0.0000 Buried
95 Q L -1.2185 Soluble
96 P L -0.7666 Soluble
97 E L -1.8428 Soluble
98 D L 0.0000 Buried
99 I L -0.3678 Soluble
100 A L 0.0000 Buried
101 T L -0.6365 Soluble
102 Y L 0.0000 Buried
103 F L 0.0000 Buried
104 C L 0.0000 Buried
105 Q L 0.0000 Buried
106 V L 0.0000 Buried
107 Y L 0.6377 Aggregation-prone
116 E L 0.2668 Aggregation-prone
117 F L 0.8484 Aggregation-prone
118 V L 0.5134 Aggregation-prone
119 V L 0.0000 Buried
120 P L -0.7539 Soluble
121 G L -0.5740 Soluble
122 T L 0.0000 Buried
123 R L -0.3680 Soluble
124 L L 0.0000 Buried
125 D L 0.0000 Buried
126 L L -0.4006 Soluble
127 K L -1.5916 Soluble
128 R L -1.5287 Soluble
129 T L -0.1062 Soluble
130 V L 1.0300 Aggregation-prone
131 A L 0.4361 Aggregation-prone
132 A L 0.1217 Aggregation-prone
133 P L 0.0000 Buried
134 S L -0.1719 Soluble
135 V L -0.0908 Soluble
136 F L 0.0000 Buried
137 I L -0.0488 Soluble
138 F L 0.0000 Buried
139 P L -0.7040 Soluble
140 P L -0.5507 Soluble
141 S L -1.3783 Soluble
142 D L -2.6612 Soluble
143 E L -2.5034 Soluble
144 Q L 0.0000 Buried
145 L L -2.0660 Soluble
146 K L -2.6435 Soluble
147 S L -1.6208 Soluble
148 G L -1.2584 Soluble
149 T L -0.9402 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 -0.7492 Soluble
159 F L 0.0000 Buried
160 Y L 0.0000 Buried
161 P L 0.0000 Buried
162 R L -1.9081 Soluble
163 E L -1.8520 Soluble
164 A L -1.6279 Soluble
165 K L -2.1633 Soluble
166 V L 0.0000 Buried
167 Q L -0.8771 Soluble
168 W L 0.0000 Buried
169 K L -0.8744 Soluble
170 V L 0.0000 Buried
171 D L -2.1452 Soluble
172 N L -1.6867 Soluble
173 A L -0.6850 Soluble
174 L L 0.2742 Aggregation-prone
175 Q L -0.5444 Soluble
176 S L -0.7856 Soluble
177 G L -1.3090 Soluble
178 N L -1.6834 Soluble
179 S L -1.3993 Soluble
180 Q L -1.1556 Soluble
181 E L -1.3555 Soluble
182 S L -0.4762 Soluble
183 V L -0.5383 Soluble
184 T L -1.0204 Soluble
185 E L -2.2848 Soluble
186 Q L -1.6683 Soluble
187 D L -1.7833 Soluble
188 S L -1.5871 Soluble
189 K L -2.2575 Soluble
190 D L -1.8741 Soluble
191 S L -1.8087 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 -0.6373 Soluble
199 L L 0.0000 Buried
200 T L -0.5452 Soluble
201 L L -0.6297 Soluble
202 S L -1.0493 Soluble
203 K L -2.0290 Soluble
204 A L -1.8566 Soluble
205 D L -2.6694 Soluble
206 Y L 0.0000 Buried
207 E L -3.6954 Soluble
208 K L -3.5502 Soluble
209 H L -3.3747 Soluble
210 K L -3.4712 Soluble
211 V L -2.0170 Soluble
212 Y L 0.0000 Buried
213 A L -1.1374 Soluble
214 C L 0.0000 Buried
215 E L -0.9234 Soluble
216 V L 0.0000 Buried
217 T L -1.1278 Soluble
218 H L 0.0000 Buried
219 Q L -1.3214 Soluble
220 G L -0.1150 Soluble
221 L L -0.0834 Soluble
222 S L -0.3882 Soluble
223 S L -0.4028 Soluble
224 P L -0.5537 Soluble
225 V L -0.0446 Soluble
226 T L -0.6536 Soluble
227 K L -0.9913 Soluble
228 S L -0.8362 Soluble
229 F L -1.2969 Soluble
230 N L -2.5802 Soluble
231 R L -3.0662 Soluble

3D Structure — colored by A4D score

Sequence - click residue to focus in viewer  |  colored by A4D score
Load structure to view sequence…
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 -0.7854 4.1542 CSV PDB
4.5 -0.8257 3.972 CSV PDB
5.0 -0.8742 3.725 CSV PDB
5.5 -0.9206 3.4445 CSV PDB
6.0 -0.954 3.151 CSV PDB
6.5 -0.9664 2.8533 CSV PDB
7.0 -0.9578 2.5546 CSV PDB
7.5 -0.9354 2.2571 CSV PDB
8.0 -0.9053 2.1285 CSV PDB
8.5 -0.8695 2.1248 CSV PDB
9.0 -0.8273 2.123 CSV PDB
Average A4D Score vs pH
Max A4D Score vs pH