Tixagevimab / 7l7e

A4DAB270_7l7e_I_J | Source PDB: 7l7e | Chains: I, J | Done
99.14
Yes
10 Å
Yes
Avg A4D Score
-0.7395
Max Score
1.8114
Min Score
-3.9364
Total Score
-318.72
Score CDR
-0.3025
Score non-CDR
-0.7994

Calculation Parameters

Chain Sequence(s) VQLVQSGPEVKKPGTSVKVSCKASGFTFMSSAVQWVRQARGQRLEWIGWIVIGSGNTNYAQKFQERVTITRDMSTSTAYMELSSLRSEDTAVYYCAAPYCSSISCNDGFDIWGQGTMVTVSSASTKGPSVFPLAPSSGGTAALGCLVKDYFPEPVTVSWNSGALTSGVHTFPAVLQSSGLYSLSSVVTVPSSSLGTQTYICNVNHKPSNTKVDKKVEPEIVLTQSPGTLSLSPGERATLSCRASQSVSSSYLAWYQQKPGQAPRLLIYGASSRATGIPDRFSGSGSGTDFTLTISRLEPEDFAVYYCQHYGSSRGWTFGQGTKVEIKRTVAAPSVFIFPPSDEQLKSGTASVVCLLNNFYPREAKVQWKVDNALQSGNSQESVTEQDSKDSTYSLSSTLTLSKADYEKHKVYACEVTHQGLSSPVTKSFNR input.pdb
Selected Chain(s) I (Heavy), J (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 -3.9364
Maximum Score 1.8114
Average Score -0.7395
Total Score -318.7225

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

Index Residue Chain A4D Score Classification
2 V I 1.1144 Aggregation-prone
3 Q I -0.5354 Soluble
4 L I 0.0000 Buried
5 V I -0.4483 Soluble
6 Q I 0.0000 Buried
7 S I -0.8139 Soluble
8 G I -0.8045 Soluble
9 P I -0.5196 Soluble
11 E I -0.7441 Soluble
12 V I -0.1616 Soluble
13 K I -1.2200 Soluble
14 K I -2.0440 Soluble
15 P I -1.8607 Soluble
16 G I -1.5293 Soluble
17 T I -1.1328 Soluble
18 S I -1.2439 Soluble
19 V I 0.0000 Buried
20 K I -1.9227 Soluble
21 V I 0.0000 Buried
22 S I -0.6829 Soluble
23 C I 0.0000 Buried
24 K I -1.3466 Soluble
25 A I 0.0000 Buried
26 S I -0.2343 Soluble
27 G I 0.2192 Aggregation-prone
28 F I 0.3947 Aggregation-prone
29 T I 0.5033 Aggregation-prone
30 F I 0.0000 Buried
35 M I 0.3192 Aggregation-prone
36 S I 0.2331 Aggregation-prone
37 S I 0.0000 Buried
38 A I 0.1721 Aggregation-prone
39 V I 0.0000 Buried
40 Q I 0.0000 Buried
41 W I 0.0000 Buried
42 V I 0.0000 Buried
43 R I 0.0000 Buried
44 Q I -1.3919 Soluble
45 A I -1.9892 Soluble
46 R I -2.6993 Soluble
47 G I -2.4488 Soluble
48 Q I -3.0139 Soluble
49 R I -2.9667 Soluble
50 L I 0.0000 Buried
51 E I -1.1475 Soluble
52 W I 0.0000 Buried
53 I I 0.0000 Buried
54 G I 0.0000 Buried
55 W I -0.2285 Soluble
56 I I 0.0000 Buried
57 V I -0.1831 Soluble
58 I I 0.0000 Buried
59 G I -0.5312 Soluble
62 S I -0.7979 Soluble
63 G I -0.9488 Soluble
64 N I -1.3986 Soluble
65 T I -0.8270 Soluble
66 N I -1.1191 Soluble
67 Y I -1.4415 Soluble
68 A I -2.2419 Soluble
69 Q I -3.1662 Soluble
70 K I -2.9297 Soluble
71 F I 0.0000 Buried
72 Q I -2.9724 Soluble
74 E I -2.9779 Soluble
75 R I -1.8071 Soluble
76 V I 0.0000 Buried
77 T I -0.8646 Soluble
78 I I 0.0000 Buried
79 T I -0.4748 Soluble
80 R I -0.9692 Soluble
81 D I -1.0302 Soluble
82 M I -0.0841 Soluble
83 S I -0.2440 Soluble
84 T I -0.5641 Soluble
85 S I -0.5660 Soluble
86 T I 0.0000 Buried
87 A I 0.0000 Buried
88 Y I -0.6410 Soluble
89 M I 0.0000 Buried
90 E I -1.2283 Soluble
91 L I 0.0000 Buried
92 S I -1.2321 Soluble
93 S I -1.3227 Soluble
94 L I 0.0000 Buried
95 R I -3.0140 Soluble
96 S I -2.2875 Soluble
97 E I -2.5227 Soluble
98 D I 0.0000 Buried
99 T I -1.1115 Soluble
100 A I 0.0000 Buried
101 V I 0.0537 Aggregation-prone
102 Y I 0.0000 Buried
103 Y I 0.0000 Buried
104 C I 0.0000 Buried
105 A I 0.0000 Buried
106 A I 0.0000 Buried
107 P I -0.5585 Soluble
108 Y I -0.0303 Soluble
109 C I 0.0000 Buried
110 S I 0.5398 Aggregation-prone
111 S I 0.7634 Aggregation-prone
111A I I 1.8114 Aggregation-prone
112B S I 0.4842 Aggregation-prone
112A C I -0.1879 Soluble
112 N I -1.4795 Soluble
113 D I -1.9926 Soluble
114 G I 0.0000 Buried
115 F I 0.0000 Buried
116 D I -1.2264 Soluble
117 I I 0.0000 Buried
118 W I -0.4950 Soluble
119 G I 0.0000 Buried
120 Q I -1.4149 Soluble
121 G I -0.6798 Soluble
122 T I 0.0000 Buried
123 M I 0.0678 Aggregation-prone
124 V I 0.0000 Buried
125 T I 0.0000 Buried
126 V I 0.0000 Buried
127 S I -1.2033 Soluble
128 S I -0.8255 Soluble
129 A I -0.6070 Soluble
130 S I -0.6878 Soluble
131 T I -0.7355 Soluble
132 K I -1.5744 Soluble
133 G I -1.6242 Soluble
134 P I -0.8215 Soluble
135 S I -0.3539 Soluble
136 V I 0.0000 Buried
137 F I 0.0000 Buried
138 P I -1.0543 Soluble
139 L I 0.0000 Buried
140 A I -0.7698 Soluble
141 P I 0.0000 Buried
142 S I -0.4986 Soluble
143 S I -0.3440 Soluble
144 G I -0.8809 Soluble
145 G I -0.8770 Soluble
146 T I -0.5596 Soluble
147 A I -0.3534 Soluble
148 A I 0.0000 Buried
149 L I 0.0000 Buried
150 G I 0.0000 Buried
151 C I 0.0000 Buried
152 L I 0.0000 Buried
153 V I 0.0000 Buried
154 K I 0.0000 Buried
155 D I -0.5039 Soluble
156 Y I 0.0000 Buried
157 F I 0.0000 Buried
158 P I 0.0000 Buried
159 E I -0.3080 Soluble
160 P I -0.7595 Soluble
161 V I -0.6612 Soluble
162 T I -0.5453 Soluble
163 V I -0.3419 Soluble
164 S I -0.4446 Soluble
165 W I 0.0000 Buried
166 N I -0.6211 Soluble
167 S I -0.6546 Soluble
168 G I -0.5593 Soluble
169 A I -0.2469 Soluble
170 L I 0.0284 Aggregation-prone
171 T I -0.1608 Soluble
172 S I -0.1651 Soluble
173 G I -0.1825 Soluble
174 V I 0.1748 Aggregation-prone
175 H I -0.3082 Soluble
176 T I 0.0077 Aggregation-prone
177 F I 0.0000 Buried
178 P I -0.5116 Soluble
179 A I 0.1686 Aggregation-prone
180 V I 0.4330 Aggregation-prone
181 L I 1.3759 Aggregation-prone
182 Q I 0.3483 Aggregation-prone
183 S I -0.1606 Soluble
184 S I -0.1993 Soluble
185 G I 0.0666 Aggregation-prone
186 L I 0.0240 Aggregation-prone
187 Y I 0.0000 Buried
188 S I 0.0000 Buried
189 L I 0.0000 Buried
190 S I 0.0000 Buried
191 S I 0.0000 Buried
192 V I 0.0000 Buried
193 V I 0.0000 Buried
194 T I -0.1741 Soluble
195 V I 0.0000 Buried
196 P I -0.7041 Soluble
197 S I -0.7520 Soluble
198 S I -0.7773 Soluble
199 S I -0.7044 Soluble
200 L I -0.8498 Soluble
201 G I -0.9887 Soluble
202 T I -0.7027 Soluble
203 Q I -1.1632 Soluble
204 T I -0.8996 Soluble
205 Y I 0.0000 Buried
206 I I -0.8575 Soluble
207 C I 0.0000 Buried
208 N I -1.4881 Soluble
209 V I 0.0000 Buried
210 N I -2.4421 Soluble
211 H I 0.0000 Buried
212 K I -2.8570 Soluble
213 P I -1.7190 Soluble
214 S I -1.9597 Soluble
215 N I -2.7054 Soluble
216 T I -2.2707 Soluble
217 K I -2.8874 Soluble
218 V I -1.7155 Soluble
219 D I -2.5262 Soluble
220 K I -1.8395 Soluble
221 K I -1.8597 Soluble
222 V I 0.0000 Buried
223 E I -2.3006 Soluble
224 P I -1.2459 Soluble
1 E J -1.6967 Soluble
2 I J -0.0444 Soluble
3 V J 0.9293 Aggregation-prone
4 L J 0.0000 Buried
5 T J -0.4951 Soluble
6 Q J 0.0000 Buried
7 S J -0.6352 Soluble
8 P J -0.4829 Soluble
9 G J -0.7452 Soluble
10 T J -0.4591 Soluble
11 L J -0.2435 Soluble
12 S J -0.6351 Soluble
13 L J -1.0608 Soluble
14 S J -1.5537 Soluble
15 P J -1.9903 Soluble
16 G J -2.5217 Soluble
17 E J -3.0702 Soluble
18 R J -3.1815 Soluble
19 A J 0.0000 Buried
20 T J -0.6583 Soluble
21 L J 0.0000 Buried
22 S J -0.9096 Soluble
23 C J 0.0000 Buried
24 R J -2.1858 Soluble
25 A J -1.0337 Soluble
26 S J -0.9015 Soluble
27 Q J -1.5821 Soluble
28 S J -1.2508 Soluble
29 V J -0.5227 Soluble
30 S J -0.2436 Soluble
36 S J -0.3537 Soluble
37 S J -0.1320 Soluble
38 Y J 0.3970 Aggregation-prone
39 L J 0.0000 Buried
40 A J 0.0000 Buried
41 W J 0.0000 Buried
42 Y J 0.0000 Buried
43 Q J 0.0000 Buried
44 Q J 0.0000 Buried
45 K J -1.3044 Soluble
46 P J -1.3797 Soluble
47 G J -1.6547 Soluble
48 Q J -2.0067 Soluble
49 A J -1.3533 Soluble
50 P J 0.0000 Buried
51 R J -1.4961 Soluble
52 L J 0.0000 Buried
53 L J 0.0000 Buried
54 I J 0.0000 Buried
55 Y J -0.5527 Soluble
56 G J -0.4489 Soluble
57 A J 0.0000 Buried
65 S J -0.7315 Soluble
66 S J -1.0454 Soluble
67 R J -1.8185 Soluble
68 A J 0.0000 Buried
69 T J -0.8220 Soluble
70 G J -0.9954 Soluble
71 I J 0.0000 Buried
72 P J -1.3073 Soluble
74 D J -2.3430 Soluble
75 R J 0.0000 Buried
76 F J 0.0000 Buried
77 S J -0.9933 Soluble
78 G J 0.0000 Buried
79 S J -0.7900 Soluble
80 G J -1.2809 Soluble
83 S J -1.2119 Soluble
84 G J -1.3053 Soluble
85 T J -1.9465 Soluble
86 D J -2.7437 Soluble
87 F J 0.0000 Buried
88 T J -0.8961 Soluble
89 L J 0.0000 Buried
90 T J -0.7523 Soluble
91 I J 0.0000 Buried
92 S J -2.4253 Soluble
93 R J -3.4059 Soluble
94 L J 0.0000 Buried
95 E J -2.1296 Soluble
96 P J -1.6728 Soluble
97 E J -2.1568 Soluble
98 D J 0.0000 Buried
99 F J -0.5617 Soluble
100 A J -0.4152 Soluble
101 V J -0.3539 Soluble
102 Y J 0.0000 Buried
103 Y J 0.0000 Buried
104 C J 0.0000 Buried
105 Q J 0.0000 Buried
106 H J 0.0000 Buried
107 Y J 0.0000 Buried
108 G J -0.2931 Soluble
109 S J -0.7532 Soluble
113 S J -1.1539 Soluble
114 R J -2.3520 Soluble
115 G J -1.4938 Soluble
116 W J 0.0000 Buried
117 T J -0.0959 Soluble
118 F J 0.1044 Aggregation-prone
119 G J 0.0000 Buried
120 Q J -1.3361 Soluble
121 G J 0.0000 Buried
122 T J 0.0000 Buried
123 K J -0.6613 Soluble
124 V J 0.0000 Buried
125 E J 0.0000 Buried
126 I J -0.6392 Soluble
127 K J -1.4576 Soluble
128 R J -0.8815 Soluble
129 T J 0.1374 Aggregation-prone
130 V J 0.9995 Aggregation-prone
131 A J 0.1678 Aggregation-prone
132 A J 0.0150 Aggregation-prone
133 P J 0.0000 Buried
134 S J -0.1212 Soluble
135 V J 0.0000 Buried
136 F J -0.0655 Soluble
137 I J 0.0000 Buried
138 F J 0.0000 Buried
139 P J -0.8447 Soluble
140 P J -0.7781 Soluble
141 S J -1.7419 Soluble
142 D J -3.0274 Soluble
143 E J -3.2288 Soluble
144 Q J 0.0000 Buried
145 L J -2.1506 Soluble
146 K J -2.8120 Soluble
147 S J -1.7248 Soluble
148 G J -1.2212 Soluble
149 T J -0.8555 Soluble
150 A J 0.0000 Buried
151 S J 0.0000 Buried
152 V J 0.0000 Buried
153 V J 0.0000 Buried
154 C J 0.0000 Buried
155 L J 0.0000 Buried
156 L J 0.0000 Buried
157 N J 0.0000 Buried
158 N J -0.9516 Soluble
159 F J 0.0000 Buried
160 Y J 0.0000 Buried
161 P J -1.5373 Soluble
162 R J -2.9203 Soluble
163 E J -3.1406 Soluble
164 A J -2.2925 Soluble
165 K J -2.5892 Soluble
166 V J -1.1783 Soluble
167 Q J -0.7033 Soluble
168 W J 0.0000 Buried
169 K J -0.5797 Soluble
170 V J 0.0000 Buried
171 D J -1.5223 Soluble
172 N J -1.3807 Soluble
173 A J -0.2963 Soluble
174 L J 0.5615 Aggregation-prone
175 Q J -0.4202 Soluble
176 S J -0.7046 Soluble
177 G J -1.3156 Soluble
178 N J -1.7040 Soluble
179 S J -1.5327 Soluble
180 Q J -1.4912 Soluble
181 E J -2.1197 Soluble
182 S J -0.8452 Soluble
183 V J -0.8012 Soluble
184 T J -1.1203 Soluble
185 E J -2.2551 Soluble
186 Q J -1.8834 Soluble
187 D J -2.0265 Soluble
188 S J -1.7684 Soluble
189 K J -2.3369 Soluble
190 D J -1.8835 Soluble
191 S J -1.8110 Soluble
192 T J 0.0000 Buried
193 Y J 0.0000 Buried
194 S J 0.0000 Buried
195 L J 0.0000 Buried
196 S J 0.0000 Buried
197 S J 0.0000 Buried
198 T J -0.7326 Soluble
199 L J 0.0000 Buried
200 T J -0.6065 Soluble
201 L J -0.8731 Soluble
202 S J -1.1589 Soluble
203 K J -2.1947 Soluble
204 A J -1.9998 Soluble
205 D J -2.7655 Soluble
206 Y J 0.0000 Buried
207 E J -3.9364 Soluble
208 K J -3.6719 Soluble
209 H J -3.3048 Soluble
210 K J -3.3672 Soluble
211 V J -1.6519 Soluble
212 Y J 0.0000 Buried
213 A J 0.0000 Buried
214 C J 0.0000 Buried
215 E J -1.0416 Soluble
216 V J 0.0000 Buried
217 T J -1.1396 Soluble
218 H J 0.0000 Buried
219 Q J -1.7616 Soluble
220 G J -0.4981 Soluble
221 L J -0.2081 Soluble
222 S J -0.4893 Soluble
223 S J -0.4065 Soluble
224 P J -0.3811 Soluble
225 V J -0.0588 Soluble
226 T J -0.6380 Soluble
227 K J -0.9331 Soluble
228 S J -0.8188 Soluble
229 F J -1.2620 Soluble
230 N J -2.4799 Soluble
231 R J -3.0775 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
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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 -0.7973 1.8831 CSV PDB
4.5 -0.841 1.8368 CSV PDB
5.0 -0.8934 1.7953 CSV PDB
5.5 -0.9441 1.7953 CSV PDB
6.0 -0.9817 1.7953 CSV PDB
6.5 -0.9971 1.7953 CSV PDB
7.0 -0.9896 1.7953 CSV PDB
7.5 -0.9668 1.7953 CSV PDB
8.0 -0.9361 1.7953 CSV PDB
8.5 -0.8998 1.7953 CSV PDB
9.0 -0.8579 1.7953 CSV PDB
Average A4D Score vs pH
Max A4D Score vs pH