Clesrovimab / 9mmv

A4DAB067_9mmv_M_N | Source PDB: 9mmv | Chains: M, N | Done
100
Yes
10 Å
Yes
Avg A4D Score
-0.7493
Max Score
1.5261
Min Score
-3.9252
Total Score
-324.45
Score CDR
-0.7246
Score non-CDR
-0.7528

Calculation Parameters

Chain Sequence(s) EVQLVESGGGLVRPGRSLRLSCTVSGFSFDDSAMSWVRQAPGKGLEWISFIKSKTYGGTKEYAASVKGRFTISRDDSKNIAYLQMNSLKTEDTAVYYCTRGAPYGGNSDYYYGLDVWGQGTTVTVSSASTKGPSVFPLAPSGTAALGCLVKDYFPEPVTVSWNSGALTSGVHTFPAVLQSSGLYSLSSVVTVPSSSLGTQTYICNVNHKPSNTKVDKKVEPKDIQMTQSPSSLSASVGDRVTITCRTSQDVRGALAWYQQKPGKAPKLLIFDASSLETGVPSRFSGSGSGTVFTLTISSLQPEDFAAYYCQQFLDFPFTFGQGTRLEIKRTVAAPSVFIFPPSDEQLKSGTASVVCLLNNFYPREAKVQWKVDNALQSGNSQESVTEQDSKDSTYSLSSTLTLSKADYEKHKVYACEVTHQGLSSPVTKSFNR input.pdb
Selected Chain(s) M (Heavy), N (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 -3.9252
Maximum Score 1.5261
Average Score -0.7493
Total Score -324.4471

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

Index Residue Chain A4D Score Classification
1 E M -2.1153 Soluble
2 V M -1.3299 Soluble
3 Q M -1.3700 Soluble
4 L M 0.0000 Buried
5 V M 1.0179 Aggregation-prone
6 E M 0.2187 Aggregation-prone
7 S M -0.4106 Soluble
8 G M -0.9239 Soluble
9 G M -0.6258 Soluble
11 G M -0.0490 Soluble
12 L M 0.2280 Aggregation-prone
13 V M 0.0000 Buried
14 R M -1.4947 Soluble
15 P M -1.6571 Soluble
16 G M -2.0137 Soluble
17 R M -2.7534 Soluble
18 S M -2.2309 Soluble
19 L M -1.7260 Soluble
20 R M -2.1229 Soluble
21 L M 0.0000 Buried
22 S M -0.3756 Soluble
23 C M 0.0000 Buried
24 T M -0.0403 Soluble
25 V M 0.0000 Buried
26 S M -0.8897 Soluble
27 G M -1.1546 Soluble
28 F M -0.7093 Soluble
29 S M -0.8627 Soluble
30 F M 0.0000 Buried
35 D M -2.7771 Soluble
36 D M -2.1744 Soluble
37 S M 0.0000 Buried
38 A M 0.0000 Buried
39 M M 0.0000 Buried
40 S M 0.0000 Buried
41 W M 0.0000 Buried
42 V M 0.0000 Buried
43 R M 0.0000 Buried
44 Q M -0.7825 Soluble
45 A M -1.2519 Soluble
46 P M -1.0333 Soluble
47 G M -1.4906 Soluble
48 K M -2.3663 Soluble
49 G M -1.6488 Soluble
50 L M 0.0000 Buried
51 E M -0.9956 Soluble
52 W M 0.0000 Buried
53 I M 0.0000 Buried
54 S M 0.0000 Buried
55 F M 0.0000 Buried
56 I M 0.0000 Buried
57 K M -1.4273 Soluble
58 S M 0.0000 Buried
59 K M -2.4412 Soluble
60 T M -1.5568 Soluble
61 Y M -0.8782 Soluble
62 G M -1.0216 Soluble
63 G M -1.2210 Soluble
64 T M -1.0667 Soluble
65 K M -1.4284 Soluble
66 E M -1.3907 Soluble
67 Y M -0.9071 Soluble
68 A M -0.7595 Soluble
69 A M -0.9484 Soluble
70 S M -0.7755 Soluble
71 V M 0.0000 Buried
72 K M -2.1643 Soluble
74 G M -1.6571 Soluble
75 R M -1.6966 Soluble
76 F M 0.0000 Buried
77 T M -1.2785 Soluble
78 I M 0.0000 Buried
79 S M -0.5491 Soluble
80 R M -1.4160 Soluble
81 D M -2.0368 Soluble
82 D M -2.4904 Soluble
83 S M -1.8644 Soluble
84 K M -2.3644 Soluble
85 N M -1.9656 Soluble
86 I M -0.8553 Soluble
87 A M 0.0000 Buried
88 Y M -0.6462 Soluble
89 L M 0.0000 Buried
90 Q M -1.6428 Soluble
91 M M 0.0000 Buried
92 N M -2.6058 Soluble
93 S M -1.9034 Soluble
94 L M 0.0000 Buried
95 K M -2.0419 Soluble
96 T M -1.5240 Soluble
97 E M -2.0960 Soluble
98 D M 0.0000 Buried
99 T M -0.6750 Soluble
100 A M 0.0000 Buried
101 V M -0.0108 Soluble
102 Y M 0.0000 Buried
103 Y M 0.0000 Buried
104 C M 0.0000 Buried
105 T M 0.0000 Buried
106 R M -0.4184 Soluble
107 G M 0.0000 Buried
108 A M 0.0000 Buried
109 P M -0.4045 Soluble
110 Y M 0.5854 Aggregation-prone
111 G M -0.4694 Soluble
111A G M -1.0379 Soluble
111B N M -1.6588 Soluble
112C S M -1.0366 Soluble
112B D M -1.2155 Soluble
112A Y M -0.2093 Soluble
112 Y M 0.0000 Buried
113 Y M 0.3892 Aggregation-prone
114 G M 0.0000 Buried
115 L M 0.0000 Buried
116 D M -0.9104 Soluble
117 V M -0.6986 Soluble
118 W M 0.0000 Buried
119 G M 0.0000 Buried
120 Q M -1.3443 Soluble
121 G M -0.6101 Soluble
122 T M -0.2457 Soluble
123 T M -0.1173 Soluble
124 V M 0.0000 Buried
125 T M -0.3239 Soluble
126 V M 0.0000 Buried
127 S M -0.6394 Soluble
128 S M -0.5070 Soluble
129 A M -0.5612 Soluble
130 S M -0.7623 Soluble
131 T M -1.0891 Soluble
132 K M -2.0321 Soluble
133 G M -1.8735 Soluble
134 P M 0.0000 Buried
135 S M -0.6538 Soluble
136 V M 0.0000 Buried
137 F M 0.0000 Buried
138 P M -1.5519 Soluble
139 L M 0.0000 Buried
140 A M 0.0000 Buried
141 P M 0.0000 Buried
142 S M -0.7004 Soluble
143 G M -0.6511 Soluble
144 T M -0.4377 Soluble
145 A M -0.2599 Soluble
146 A M 0.0000 Buried
147 L M 0.0000 Buried
148 G M 0.0000 Buried
149 C M 0.0000 Buried
150 L M 0.0000 Buried
151 V M 0.0000 Buried
152 K M 0.0000 Buried
153 D M -0.8352 Soluble
154 Y M 0.0000 Buried
155 F M 0.0000 Buried
156 P M -0.7231 Soluble
157 E M -0.8365 Soluble
158 P M -0.5957 Soluble
159 V M -0.2673 Soluble
160 T M -0.2190 Soluble
161 V M 0.0435 Aggregation-prone
162 S M -0.3840 Soluble
163 W M 0.0000 Buried
164 N M -0.5501 Soluble
165 S M -0.6237 Soluble
166 G M -0.4695 Soluble
167 A M -0.1627 Soluble
168 L M 0.0536 Aggregation-prone
169 T M -0.1237 Soluble
170 S M -0.1457 Soluble
171 G M -0.0965 Soluble
172 V M 0.2493 Aggregation-prone
173 H M -0.3786 Soluble
174 T M -0.1514 Soluble
175 F M 0.0000 Buried
176 P M -0.2453 Soluble
177 A M 0.3970 Aggregation-prone
178 V M 0.6758 Aggregation-prone
179 L M 1.5261 Aggregation-prone
180 Q M 0.4511 Aggregation-prone
181 S M -0.0896 Soluble
182 S M -0.2065 Soluble
183 G M 0.0368 Aggregation-prone
184 L M -0.0981 Soluble
185 Y M 0.3876 Aggregation-prone
186 S M 0.0000 Buried
187 L M 0.4172 Aggregation-prone
188 S M 0.0000 Buried
189 S M 0.0000 Buried
190 V M 0.0000 Buried
191 V M 0.0000 Buried
192 T M -0.1568 Soluble
193 V M 0.0000 Buried
194 P M -0.5896 Soluble
195 S M -0.6181 Soluble
196 S M -0.6489 Soluble
197 S M -0.6261 Soluble
198 L M -0.8564 Soluble
199 G M -1.1323 Soluble
200 T M -0.7386 Soluble
201 Q M -1.1639 Soluble
202 T M -1.0600 Soluble
203 Y M 0.0000 Buried
204 I M -1.2138 Soluble
205 C M 0.0000 Buried
206 N M -1.5634 Soluble
207 V M 0.0000 Buried
208 N M -1.7815 Soluble
209 H M 0.0000 Buried
210 K M -2.6111 Soluble
211 P M -1.7195 Soluble
212 S M -2.0458 Soluble
213 N M -2.4079 Soluble
214 T M -2.1227 Soluble
215 K M -2.7137 Soluble
216 V M -1.6886 Soluble
217 D M -2.6609 Soluble
218 K M -2.1230 Soluble
219 K M -2.6343 Soluble
220 V M 0.0000 Buried
221 E M -2.9594 Soluble
222 P M -2.0655 Soluble
223 K M -2.5127 Soluble
1 D N -2.1736 Soluble
2 I N -1.7760 Soluble
3 Q N -1.9222 Soluble
4 M N -1.4196 Soluble
5 T N -1.1187 Soluble
6 Q N 0.0000 Buried
7 S N -0.6359 Soluble
8 P N -0.6115 Soluble
9 S N -0.8237 Soluble
10 S N -1.0212 Soluble
11 L N -0.4918 Soluble
12 S N -0.9814 Soluble
13 A N 0.0000 Buried
14 S N -0.7275 Soluble
15 V N 0.2949 Aggregation-prone
16 G N -0.8902 Soluble
17 D N -1.9984 Soluble
18 R N -2.4712 Soluble
19 V N 0.0000 Buried
20 T N -0.5225 Soluble
21 I N 0.0000 Buried
22 T N -0.3427 Soluble
23 C N 0.0000 Buried
24 R N -1.6994 Soluble
25 T N -1.5688 Soluble
26 S N -1.8269 Soluble
27 Q N -2.7405 Soluble
28 D N -2.8464 Soluble
29 V N 0.0000 Buried
36 R N -2.5766 Soluble
37 G N -1.3724 Soluble
38 A N 0.0000 Buried
39 L N 0.0000 Buried
40 A N 0.0000 Buried
41 W N 0.0000 Buried
42 Y N 0.0000 Buried
43 Q N 0.0000 Buried
44 Q N 0.0000 Buried
45 K N -2.5293 Soluble
46 P N -1.8807 Soluble
47 G N -1.9291 Soluble
48 K N -2.8318 Soluble
49 A N -1.8721 Soluble
50 P N 0.0000 Buried
51 K N -1.7236 Soluble
52 L N 0.0000 Buried
53 L N 0.0000 Buried
54 I N 0.0000 Buried
55 F N 0.1517 Aggregation-prone
56 D N -0.2095 Soluble
57 A N 0.0000 Buried
65 S N -0.3596 Soluble
66 S N 0.0223 Aggregation-prone
67 L N 0.3770 Aggregation-prone
68 E N -0.1114 Soluble
69 T N -0.1839 Soluble
70 G N -0.5287 Soluble
71 V N -0.2295 Soluble
72 P N -0.3085 Soluble
74 S N -0.4127 Soluble
75 R N -0.8989 Soluble
76 F N 0.0000 Buried
77 S N -0.2580 Soluble
78 G N -0.3506 Soluble
79 S N -0.4814 Soluble
80 G N -0.4571 Soluble
83 S N -1.0138 Soluble
84 G N -1.6803 Soluble
85 T N -1.3108 Soluble
86 V N -0.0697 Soluble
87 F N 0.0000 Buried
88 T N -0.3060 Soluble
89 L N 0.0000 Buried
90 T N -0.7253 Soluble
91 I N 0.0000 Buried
92 S N -1.5562 Soluble
93 S N -1.3740 Soluble
94 L N 0.0000 Buried
95 Q N -1.4292 Soluble
96 P N -1.1283 Soluble
97 E N -2.2259 Soluble
98 D N -1.4715 Soluble
99 F N -0.8629 Soluble
100 A N 0.0000 Buried
101 A N -0.9129 Soluble
102 Y N 0.0000 Buried
103 Y N 0.0000 Buried
104 C N 0.0000 Buried
105 Q N 0.0000 Buried
106 Q N 0.0000 Buried
107 F N 0.0000 Buried
108 L N -0.8759 Soluble
109 D N -1.2400 Soluble
114 F N -0.1294 Soluble
115 P N -0.2658 Soluble
116 F N 0.0000 Buried
117 T N -0.7063 Soluble
118 F N 0.0000 Buried
119 G N 0.0000 Buried
120 Q N -1.7281 Soluble
121 G N 0.0000 Buried
122 T N 0.0000 Buried
123 R N -1.2891 Soluble
124 L N 0.0000 Buried
125 E N -1.1605 Soluble
126 I N -0.4612 Soluble
127 K N -1.4508 Soluble
128 R N -1.2440 Soluble
129 T N 0.0281 Aggregation-prone
130 V N 1.0526 Aggregation-prone
131 A N 0.3574 Aggregation-prone
132 A N -0.0135 Soluble
133 P N 0.0000 Buried
134 S N 0.0572 Aggregation-prone
135 V N 0.2105 Aggregation-prone
136 F N 0.2635 Aggregation-prone
137 I N 0.1249 Aggregation-prone
138 F N 0.0000 Buried
139 P N 0.0000 Buried
140 P N 0.0000 Buried
141 S N 0.0000 Buried
142 D N -2.6825 Soluble
143 E N -2.8620 Soluble
144 Q N 0.0000 Buried
145 L N -1.9565 Soluble
146 K N -2.6836 Soluble
147 S N -1.8565 Soluble
148 G N -1.4946 Soluble
149 T N -0.9192 Soluble
150 A N 0.0000 Buried
151 S N 0.0000 Buried
152 V N 0.0000 Buried
153 V N 0.0000 Buried
154 C N 0.0000 Buried
155 L N 0.0000 Buried
156 L N 0.0000 Buried
157 N N 0.0000 Buried
158 N N -0.9671 Soluble
159 F N 0.0000 Buried
160 Y N 0.0000 Buried
161 P N -1.5302 Soluble
162 R N -2.4279 Soluble
163 E N -2.9679 Soluble
164 A N -2.1772 Soluble
165 K N -2.2818 Soluble
166 V N -1.1239 Soluble
167 Q N -0.5065 Soluble
168 W N 0.0000 Buried
169 K N -0.4546 Soluble
170 V N 0.0000 Buried
171 D N -1.7902 Soluble
172 N N -1.5268 Soluble
173 A N -0.2973 Soluble
174 L N 0.5866 Aggregation-prone
175 Q N -0.4303 Soluble
176 S N -0.6407 Soluble
177 G N -1.1356 Soluble
178 N N -1.3612 Soluble
179 S N -1.3385 Soluble
180 Q N -1.2470 Soluble
181 E N -1.9885 Soluble
182 S N 0.0000 Buried
183 V N -0.9006 Soluble
184 T N 0.0000 Buried
185 E N -2.3698 Soluble
186 Q N -2.1703 Soluble
187 D N -2.5645 Soluble
188 S N -2.0119 Soluble
189 K N -2.5019 Soluble
190 D N -2.1188 Soluble
191 S N -2.0561 Soluble
192 T N 0.0000 Buried
193 Y N 0.0000 Buried
194 S N 0.0000 Buried
195 L N 0.0000 Buried
196 S N 0.0000 Buried
197 S N 0.0000 Buried
198 T N 0.0000 Buried
199 L N 0.0000 Buried
200 T N -0.7049 Soluble
201 L N 0.0000 Buried
202 S N -1.6421 Soluble
203 K N -2.9554 Soluble
204 A N -2.2466 Soluble
205 D N -2.3744 Soluble
206 Y N -2.7283 Soluble
207 E N -3.9252 Soluble
208 K N -3.6500 Soluble
209 H N 0.0000 Buried
210 K N -3.1559 Soluble
211 V N -1.6145 Soluble
212 Y N 0.0000 Buried
213 A N 0.0000 Buried
214 C N 0.0000 Buried
215 E N -0.6233 Soluble
216 V N 0.0000 Buried
217 T N -1.1607 Soluble
218 H N 0.0000 Buried
219 Q N -1.2126 Soluble
220 G N -0.2860 Soluble
221 L N -0.1547 Soluble
222 S N -0.4446 Soluble
223 S N -0.3772 Soluble
224 P N -0.3401 Soluble
225 V N 0.2849 Aggregation-prone
226 T N -0.3350 Soluble
227 K N -0.6213 Soluble
228 S N -1.0967 Soluble
229 F N -1.0875 Soluble
230 N N -2.2095 Soluble
231 R N -3.1810 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 -0.7747 2.796 CSV PDB
4.5 -0.8216 2.5696 CSV PDB
5.0 -0.8766 2.2798 CSV PDB
5.5 -0.9287 1.9962 CSV PDB
6.0 -0.9657 1.9462 CSV PDB
6.5 -0.9778 1.9079 CSV PDB
7.0 -0.9655 1.8858 CSV PDB
7.5 -0.9368 1.8762 CSV PDB
8.0 -0.8989 1.8728 CSV PDB
8.5 -0.8538 1.8717 CSV PDB
9.0 -0.801 1.9402 CSV PDB
Average A4D Score vs pH
Max A4D Score vs pH