Teropavimab / 7n28

A4DAB261_7n28_J_K | Source PDB: 7n28 | Chains: J, K | Done
99.55
Yes
10 Å
Yes
Avg A4D Score
-0.7601
Max Score
1.4694
Min Score
-3.6071
Total Score
-319.22
Score CDR
-0.8044
Score non-CDR
-0.7555

Calculation Parameters

Chain Sequence(s) QVQLLQSGAAVTKPGASVRVSCEASGYNIRDYFIHWWRQAPGQGLQWVGWINPKTGQPNNPRQFQGRVSLTRHASWDFDTYSFYMDLKALRSDDTAVYFCARQRSDYWDFDVWGSGTQVTVSSASTKGPSVFPLAPSTAALGCLVKDYFPEPVTVSWNSGALTSGVHTFPAVLQSSGLYSLSSVVTVPSSSLGTQTYICNVNHKPSNTKVDKKVEPDIQMTQSPSSLSASVGDTVTITCQANGYLNWYQQRRGKAPKLLIYDGSKLERGVPSRFSGRRWGQEYNLTINNLQPEDIATYFCQVYEFVVPGTRLDLKRTVAAPSVFIFPPSDEQLKSGTASVVCLLNNFYPREAKVQWKVDNALQSGNSQESVTEQDSKDSTYSLSSTLTLSKADYEKHKVYACEVTHQGLSSPVTKSFNRG input.pdb
Selected Chain(s) J (Heavy), K (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 -3.6071
Maximum Score 1.4694
Average Score -0.7601
Total Score -319.2218

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

Index Residue Chain A4D Score Classification
1 Q J -1.3467 Soluble
2 V J -0.9034 Soluble
3 Q J -1.2568 Soluble
4 L J 0.0000 Buried
5 L J 0.0460 Aggregation-prone
6 Q J -0.3755 Soluble
7 S J -0.7546 Soluble
8 G J -0.6455 Soluble
9 A J -0.1608 Soluble
11 A J 0.4218 Aggregation-prone
12 V J 1.2327 Aggregation-prone
13 T J -0.1231 Soluble
14 K J -1.7991 Soluble
15 P J -1.6097 Soluble
16 G J -1.4434 Soluble
17 A J -1.1665 Soluble
18 S J -1.4630 Soluble
19 V J -1.1908 Soluble
20 R J -2.2553 Soluble
21 V J 0.0000 Buried
22 S J -0.7782 Soluble
23 C J 0.0000 Buried
24 E J -1.0636 Soluble
25 A J 0.0000 Buried
26 S J -1.2030 Soluble
27 G J -1.3237 Soluble
28 Y J -1.1824 Soluble
29 N J -2.0488 Soluble
30 I J 0.0000 Buried
35 R J -2.7831 Soluble
36 D J -2.8125 Soluble
37 Y J -1.2479 Soluble
38 F J -0.3269 Soluble
39 I J 0.0000 Buried
40 H J 0.0000 Buried
41 W J 0.0000 Buried
42 W J 0.0000 Buried
43 R J 0.0000 Buried
44 Q J -0.8014 Soluble
45 A J -1.0350 Soluble
46 P J -0.9338 Soluble
47 G J -1.4361 Soluble
48 Q J -1.6955 Soluble
49 G J -0.9943 Soluble
50 L J 0.0000 Buried
51 Q J -0.3458 Soluble
52 W J 0.0893 Aggregation-prone
53 V J 0.0000 Buried
54 G J 0.0000 Buried
55 W J -0.2841 Soluble
56 I J 0.0000 Buried
57 N J -1.5636 Soluble
58 P J 0.0000 Buried
59 K J -2.6609 Soluble
62 T J -1.5898 Soluble
63 G J -1.5310 Soluble
64 Q J -1.8950 Soluble
65 P J -1.3640 Soluble
66 N J -1.6862 Soluble
67 N J -1.6780 Soluble
68 P J -1.9328 Soluble
69 R J -3.0387 Soluble
70 Q J -2.6105 Soluble
71 F J 0.0000 Buried
72 Q J -2.6758 Soluble
74 G J -1.8085 Soluble
75 R J -1.6014 Soluble
76 V J 0.0000 Buried
77 S J -1.3479 Soluble
78 L J 0.0000 Buried
79 T J -0.8616 Soluble
80 R J -1.3294 Soluble
81 H J -0.9712 Soluble
82 A J -0.5104 Soluble
83 S J -0.1799 Soluble
84 W J 0.3353 Aggregation-prone
85 D J -1.1700 Soluble
85A F J -0.4996 Soluble
85B D J -1.9536 Soluble
85C T J -1.2263 Soluble
85D Y J 0.0000 Buried
86 S J -0.7420 Soluble
87 F J 0.0000 Buried
88 Y J -0.9083 Soluble
89 M J 0.0000 Buried
90 D J -1.8696 Soluble
91 L J 0.0000 Buried
92 K J -1.9793 Soluble
93 A J -1.0833 Soluble
94 L J 0.0000 Buried
95 R J -2.2424 Soluble
96 S J -1.9565 Soluble
97 D J -2.2346 Soluble
98 D J 0.0000 Buried
99 T J -0.6898 Soluble
100 A J 0.0000 Buried
101 V J -0.2216 Soluble
102 Y J 0.0000 Buried
103 F J 0.0000 Buried
104 C J 0.0000 Buried
105 A J 0.0000 Buried
106 R J -0.0040 Soluble
107 Q J 0.0000 Buried
108 R J -0.8753 Soluble
109 S J -1.1069 Soluble
110 D J -1.5450 Soluble
112 Y J -0.2538 Soluble
113 W J -0.2844 Soluble
114 D J 0.0000 Buried
115 F J 0.0000 Buried
116 D J -0.5989 Soluble
117 V J -0.4330 Soluble
118 W J -0.3479 Soluble
119 G J 0.0000 Buried
120 S J -0.6844 Soluble
121 G J -0.6871 Soluble
122 T J 0.0000 Buried
123 Q J -0.4818 Soluble
124 V J 0.0000 Buried
125 T J 0.0000 Buried
126 V J 0.0000 Buried
127 S J -0.9961 Soluble
128 S J -0.6896 Soluble
129 A J -0.6127 Soluble
130 S J -0.4409 Soluble
131 T J -0.4444 Soluble
132 K J -0.8624 Soluble
133 G J -1.1869 Soluble
134 P J -0.6861 Soluble
135 S J -0.7516 Soluble
136 V J 0.0000 Buried
137 F J 0.0000 Buried
138 P J 0.0000 Buried
139 L J 0.0000 Buried
140 A J -0.6520 Soluble
141 P J -0.3169 Soluble
142 S J -0.9367 Soluble
143 T J -0.1992 Soluble
144 A J 0.0000 Buried
145 A J 0.1071 Aggregation-prone
146 L J 0.0000 Buried
147 G J 0.0000 Buried
148 C J 0.0000 Buried
149 L J 0.1728 Aggregation-prone
150 V J 0.0000 Buried
151 K J -0.3773 Soluble
152 D J -0.6725 Soluble
153 Y J 0.0000 Buried
154 F J 0.0000 Buried
155 P J -0.4710 Soluble
156 E J -0.8117 Soluble
157 P J -0.8786 Soluble
158 V J -0.5103 Soluble
159 T J -0.2288 Soluble
160 V J 0.0760 Aggregation-prone
161 S J -0.2131 Soluble
162 W J 0.0000 Buried
163 N J -0.7457 Soluble
164 S J -0.5567 Soluble
165 G J -0.4267 Soluble
166 A J -0.2976 Soluble
167 L J 0.0324 Aggregation-prone
168 T J -0.0401 Soluble
169 S J -0.0582 Soluble
170 G J -0.0329 Soluble
171 V J 0.4318 Aggregation-prone
172 H J -0.2777 Soluble
173 T J -0.1296 Soluble
174 F J 0.0000 Buried
175 P J -0.2187 Soluble
176 A J 0.4439 Aggregation-prone
177 V J 0.9564 Aggregation-prone
178 L J 1.4694 Aggregation-prone
179 Q J 0.2633 Aggregation-prone
180 S J -0.3567 Soluble
181 S J -0.2011 Soluble
182 G J -0.0280 Soluble
183 L J 0.2344 Aggregation-prone
184 Y J 0.5115 Aggregation-prone
185 S J 0.0000 Buried
186 L J 0.4356 Aggregation-prone
187 S J 0.1649 Aggregation-prone
188 S J 0.0000 Buried
189 V J 0.2483 Aggregation-prone
190 V J 0.0000 Buried
191 T J 0.0236 Aggregation-prone
192 V J -0.0492 Soluble
193 P J -0.2839 Soluble
194 S J -0.3181 Soluble
195 S J -0.4233 Soluble
196 S J 0.0000 Buried
197 L J -0.5353 Soluble
198 G J -0.9473 Soluble
199 T J -0.8526 Soluble
200 Q J -1.1149 Soluble
201 T J -1.1902 Soluble
202 Y J -0.8816 Soluble
203 I J -1.1087 Soluble
204 C J 0.0000 Buried
205 N J -1.2578 Soluble
206 V J 0.0000 Buried
207 N J -1.6336 Soluble
208 H J 0.0000 Buried
209 K J -1.9027 Soluble
210 P J -1.2832 Soluble
211 S J -1.4854 Soluble
212 N J -2.1458 Soluble
213 T J -1.7792 Soluble
214 K J -2.4348 Soluble
215 V J -1.4585 Soluble
216 D J -2.6103 Soluble
217 K J -2.2556 Soluble
218 K J -2.6017 Soluble
219 V J 0.0000 Buried
220 E J -2.2804 Soluble
221 P J -1.3648 Soluble
1 D K -2.0989 Soluble
2 I K -1.2370 Soluble
3 Q K -1.5597 Soluble
4 M K -0.7682 Soluble
5 T K -0.7099 Soluble
6 Q K -0.5419 Soluble
7 S K -0.5551 Soluble
8 P K -0.5199 Soluble
9 S K -0.6502 Soluble
10 S K -0.6265 Soluble
11 L K -0.1506 Soluble
12 S K -0.2570 Soluble
13 A K -0.2352 Soluble
14 S K -0.3075 Soluble
15 V K 0.5182 Aggregation-prone
16 G K -0.8500 Soluble
17 D K -0.9998 Soluble
18 T K -0.7650 Soluble
19 V K -0.2059 Soluble
20 T K -0.1762 Soluble
21 I K 0.0000 Buried
22 T K -0.6627 Soluble
23 C K 0.0000 Buried
24 Q K -2.1626 Soluble
25 A K 0.0000 Buried
27 N K -2.3561 Soluble
28 G K -0.9541 Soluble
38 Y K 0.0331 Aggregation-prone
39 L K 0.0000 Buried
40 N K 0.0000 Buried
41 W K 0.0000 Buried
42 Y K 0.0000 Buried
43 Q K -1.0854 Soluble
44 Q K 0.0000 Buried
45 R K -2.7244 Soluble
46 R K -3.2157 Soluble
47 G K -2.4555 Soluble
48 K K -2.9558 Soluble
49 A K -1.6378 Soluble
50 P K 0.0000 Buried
51 K K -1.4861 Soluble
52 L K 0.0000 Buried
53 L K 0.0000 Buried
54 I K 0.0000 Buried
55 Y K 0.0000 Buried
56 D K -0.8185 Soluble
57 G K 0.0000 Buried
65 S K -1.9462 Soluble
66 K K -2.2601 Soluble
67 L K -1.0759 Soluble
68 E K -1.3845 Soluble
69 R K -2.1910 Soluble
70 G K -1.2873 Soluble
71 V K -0.7974 Soluble
72 P K -0.5510 Soluble
74 S K -0.6272 Soluble
75 R K -0.8442 Soluble
76 F K 0.0000 Buried
77 S K -0.9677 Soluble
78 G K -1.6950 Soluble
79 R K -2.9118 Soluble
80 R K -2.8579 Soluble
83 W K -0.9449 Soluble
84 G K -1.6420 Soluble
85 Q K -2.4613 Soluble
86 E K -2.4231 Soluble
87 Y K 0.0000 Buried
88 N K -1.7906 Soluble
89 L K 0.0000 Buried
90 T K -0.5885 Soluble
91 I K 0.0000 Buried
92 N K -1.2155 Soluble
93 N K -1.6529 Soluble
94 L K 0.0000 Buried
95 Q K -1.2516 Soluble
96 P K -1.1412 Soluble
97 E K -2.1390 Soluble
98 D K -1.2309 Soluble
99 I K -0.9711 Soluble
100 A K -1.1999 Soluble
101 T K -1.1086 Soluble
102 Y K 0.0000 Buried
103 F K 0.0000 Buried
104 C K 0.0000 Buried
105 Q K 0.0000 Buried
106 V K 0.0000 Buried
107 Y K 0.5989 Aggregation-prone
116 E K 0.2988 Aggregation-prone
117 F K 1.2046 Aggregation-prone
118 V K 0.7020 Aggregation-prone
119 V K 0.1499 Aggregation-prone
120 P K -0.6371 Soluble
121 G K -0.6695 Soluble
122 T K 0.0000 Buried
123 R K -1.2562 Soluble
124 L K -0.4013 Soluble
125 D K -0.5712 Soluble
126 L K -0.2904 Soluble
127 K K -1.0495 Soluble
128 R K -1.6247 Soluble
129 T K -0.6796 Soluble
130 V K 0.7711 Aggregation-prone
131 A K 0.2516 Aggregation-prone
132 A K -0.0916 Soluble
133 P K -0.3155 Soluble
134 S K -0.4133 Soluble
135 V K 0.0000 Buried
136 F K 0.2227 Aggregation-prone
137 I K 0.0495 Aggregation-prone
138 F K 0.0000 Buried
139 P K 0.0000 Buried
140 P K -0.8654 Soluble
141 S K -1.8457 Soluble
142 D K -3.0801 Soluble
143 E K -3.2098 Soluble
144 Q K 0.0000 Buried
145 L K -2.1902 Soluble
146 K K -2.8519 Soluble
147 S K -1.7371 Soluble
148 G K -1.2109 Soluble
149 T K -0.7841 Soluble
150 A K 0.0000 Buried
151 S K -0.0759 Soluble
152 V K 0.0000 Buried
153 V K 0.2722 Aggregation-prone
154 C K 0.0000 Buried
155 L K 0.0000 Buried
156 L K 0.0000 Buried
157 N K -0.7162 Soluble
158 N K -1.4730 Soluble
159 F K 0.0000 Buried
160 Y K 0.0000 Buried
161 P K -1.3712 Soluble
162 R K -2.3193 Soluble
163 E K -2.8640 Soluble
164 A K -2.0704 Soluble
165 K K -2.0901 Soluble
166 V K -0.4130 Soluble
167 Q K -0.5834 Soluble
168 W K 0.0000 Buried
169 K K -0.3380 Soluble
170 V K -0.7183 Soluble
171 D K -1.3798 Soluble
172 N K -1.2968 Soluble
173 A K -0.3876 Soluble
174 L K 0.4263 Aggregation-prone
175 Q K -0.7233 Soluble
176 S K -0.9300 Soluble
177 G K -1.5528 Soluble
178 N K -1.9572 Soluble
179 S K -1.5716 Soluble
180 Q K -1.3413 Soluble
181 E K -0.4971 Soluble
182 S K -0.3149 Soluble
183 V K -0.2647 Soluble
184 T K -1.0056 Soluble
185 E K -2.3419 Soluble
186 Q K -1.8358 Soluble
187 D K -2.2630 Soluble
188 S K -2.0463 Soluble
189 K K -2.8221 Soluble
190 D K -2.9804 Soluble
191 S K -2.2363 Soluble
192 T K 0.0000 Buried
193 Y K 0.0000 Buried
194 S K 0.0000 Buried
195 L K -0.2425 Soluble
196 S K 0.0000 Buried
197 S K 0.0000 Buried
198 T K -0.5377 Soluble
199 L K 0.0000 Buried
200 T K -0.5877 Soluble
201 L K -0.5790 Soluble
202 S K -1.0204 Soluble
203 K K -1.8587 Soluble
204 A K -1.8021 Soluble
205 D K -2.4175 Soluble
206 Y K 0.0000 Buried
207 E K -3.6071 Soluble
208 K K -3.3902 Soluble
209 H K -2.7182 Soluble
210 K K -2.7011 Soluble
211 V K -0.9207 Soluble
212 Y K 0.0000 Buried
213 A K 0.0000 Buried
214 C K 0.0000 Buried
215 E K 0.0000 Buried
216 V K 0.0000 Buried
217 T K -0.8746 Soluble
218 H K 0.0000 Buried
219 Q K -1.7811 Soluble
220 G K -0.5752 Soluble
221 L K -0.1938 Soluble
222 S K -0.4221 Soluble
223 S K -0.3565 Soluble
224 P K -0.1573 Soluble
225 V K 0.2432 Aggregation-prone
226 T K -0.2948 Soluble
227 K K -0.6006 Soluble
228 S K -0.6635 Soluble
229 F K -0.8085 Soluble
230 N K -1.8446 Soluble
231 R K -2.3631 Soluble
232 G K -1.6842 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
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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 -0.6682 4.0476 CSV PDB
4.5 -0.7149 3.802 CSV PDB
5.0 -0.7693 3.532 CSV PDB
5.5 -0.8213 3.2564 CSV PDB
6.0 -0.8599 3.1625 CSV PDB
6.5 -0.877 3.0872 CSV PDB
7.0 -0.8741 3.038 CSV PDB
7.5 -0.8591 3.0143 CSV PDB
8.0 -0.8376 3.0053 CSV PDB
8.5 -0.8101 3.0022 CSV PDB
9.0 -0.7751 3.001 CSV PDB
Average A4D Score vs pH
Max A4D Score vs pH