Bebtelovimab / 7mmo

A4DAB036_7mmo_D_E | Source PDB: 7mmo | Chains: D, E | Done
100
Yes
10 Å
Yes
Avg A4D Score
-0.6686
Max Score
1.6567
Min Score
-3.6029
Total Score
-281.48
Score CDR
-0.4763
Score non-CDR
-0.6939

Calculation Parameters

Chain Sequence(s) ITLKESGPTLVKPTQTLTLTCTFSGFSLSISGVGVGWLRQPPGKALEWLALIYWDDDKRYSPSLKSRLTISKDTSKNQVVLKMTNIDPVDTATYYCAHHSISTIFDHWGQGTLVTVSSASTKGPSVFPLAPCSTAALGCLVKDYFPEPVTVSWNSGALTSGVHTFPAVLQSSGLYSLSSVVTVPSKTYTCNVDHKPSNTKVDKRVHHSALTQPASVSGSPGQSITISCTATSSDVGDYNYVSWYQQHPGKAPKLMIFEVSDRPSGISNRFSGSKSGNTASLTISGLQAEDEADYYCSSYTTSSAVFGGGTKLTVLGRTVAAPSVFIFPPSDEQLKSGTASVVCLLNNFYPREAKVQWKVDNALQSGNSQESVTEQDSKDSTYSLSSTLTLSKADYEKHKVYACEVTQGTTSVTKSFNRGEC input.pdb
Selected Chain(s) D (Heavy), E (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 -3.6029
Maximum Score 1.6567
Average Score -0.6686
Total Score -281.4788

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

Index Residue Chain A4D Score Classification
2 I D 0.6889 Aggregation-prone
3 T D -0.2559 Soluble
4 L D 0.0000 Buried
5 K D -1.7294 Soluble
6 E D 0.0000 Buried
7 S D -0.5152 Soluble
8 G D -0.3446 Soluble
9 P D -0.0626 Soluble
11 T D 0.3316 Aggregation-prone
12 L D 0.3404 Aggregation-prone
13 V D 0.0000 Buried
14 K D -1.7092 Soluble
15 P D -1.4552 Soluble
16 T D -1.6466 Soluble
17 Q D -1.8221 Soluble
18 T D -1.4143 Soluble
19 L D 0.0000 Buried
20 T D -0.6040 Soluble
21 L D 0.0000 Buried
22 T D -0.5176 Soluble
23 C D 0.0000 Buried
24 T D -1.0468 Soluble
25 F D 0.0000 Buried
26 S D -0.3178 Soluble
27 G D 0.0226 Aggregation-prone
28 F D 0.4211 Aggregation-prone
29 S D 0.4547 Aggregation-prone
30 L D 0.0000 Buried
31 S D 0.3238 Aggregation-prone
34 I D 1.6567 Aggregation-prone
35 S D 0.4133 Aggregation-prone
36 G D 0.2838 Aggregation-prone
37 V D 0.5859 Aggregation-prone
38 G D 0.0000 Buried
39 V D 0.0000 Buried
40 G D 0.0000 Buried
41 W D 0.0000 Buried
42 L D 0.0000 Buried
43 R D 0.0000 Buried
44 Q D -0.7760 Soluble
45 P D -0.5621 Soluble
46 P D -0.8394 Soluble
47 G D -1.4662 Soluble
48 K D -2.2276 Soluble
49 A D -1.4063 Soluble
50 L D 0.0000 Buried
51 E D -0.9867 Soluble
52 W D 0.0000 Buried
53 L D 0.0000 Buried
54 A D 0.0000 Buried
55 L D 0.0000 Buried
56 I D 0.0000 Buried
57 Y D -1.2107 Soluble
58 W D -0.7104 Soluble
59 D D -2.3192 Soluble
63 D D -2.7419 Soluble
64 D D -2.6532 Soluble
65 K D -2.1779 Soluble
66 R D -2.1121 Soluble
67 Y D -1.2971 Soluble
68 S D 0.0000 Buried
69 P D -1.0750 Soluble
70 S D -0.7762 Soluble
71 L D -0.9603 Soluble
72 K D -2.1137 Soluble
74 S D -1.3546 Soluble
75 R D -1.4607 Soluble
76 L D 0.0000 Buried
77 T D -0.9797 Soluble
78 I D 0.0000 Buried
79 S D -0.8307 Soluble
80 K D -1.0686 Soluble
81 D D -1.4330 Soluble
82 T D -1.2134 Soluble
83 S D -1.4215 Soluble
84 K D -2.2943 Soluble
85 N D -1.6512 Soluble
86 Q D -1.3685 Soluble
87 V D 0.0000 Buried
88 V D -0.1556 Soluble
89 L D 0.0000 Buried
90 K D -1.0528 Soluble
91 M D 0.0000 Buried
92 T D -1.4253 Soluble
93 N D -2.0851 Soluble
94 I D 0.0000 Buried
95 D D -1.1144 Soluble
96 P D 0.0045 Aggregation-prone
97 V D 1.3721 Aggregation-prone
98 D D 0.0000 Buried
99 T D 0.6313 Aggregation-prone
100 A D 0.0000 Buried
101 T D 0.2436 Aggregation-prone
102 Y D 0.0000 Buried
103 Y D 0.0000 Buried
104 C D 0.0000 Buried
105 A D 0.0000 Buried
106 H D -0.1617 Soluble
107 H D 0.0000 Buried
108 S D 0.4490 Aggregation-prone
109 I D 1.1507 Aggregation-prone
110 S D 0.0997 Aggregation-prone
113 T D -0.0084 Soluble
114 I D 0.0000 Buried
115 F D 0.0000 Buried
116 D D -0.6794 Soluble
117 H D -0.8491 Soluble
118 W D 0.0000 Buried
119 G D 0.0000 Buried
120 Q D -1.9300 Soluble
121 G D 0.0000 Buried
122 T D 0.0042 Aggregation-prone
123 L D 1.0192 Aggregation-prone
124 V D 0.0000 Buried
125 T D 0.4251 Aggregation-prone
126 V D 0.0000 Buried
127 S D 0.0000 Buried
128 S D -0.7562 Soluble
129 A D -0.5891 Soluble
130 S D -0.4979 Soluble
131 T D -0.7797 Soluble
132 K D -1.2073 Soluble
133 G D -1.4122 Soluble
134 P D 0.0000 Buried
135 S D -0.4737 Soluble
136 V D 0.0000 Buried
137 F D 0.0000 Buried
138 P D -1.0798 Soluble
139 L D 0.0000 Buried
140 A D -0.4197 Soluble
141 P D -0.1150 Soluble
142 C D -0.2437 Soluble
143 S D -0.3318 Soluble
144 T D -0.2653 Soluble
145 A D -0.3182 Soluble
146 A D 0.0000 Buried
147 L D 0.0000 Buried
148 G D 0.0000 Buried
149 C D 0.0000 Buried
150 L D 0.0000 Buried
151 V D 0.0000 Buried
152 K D 0.0000 Buried
153 D D -0.6599 Soluble
154 Y D 0.0000 Buried
155 F D 0.0000 Buried
156 P D -1.1967 Soluble
157 E D -1.7786 Soluble
158 P D -1.5147 Soluble
159 V D -1.1172 Soluble
160 T D -0.7895 Soluble
161 V D -0.4236 Soluble
162 S D -0.5097 Soluble
163 W D 0.0000 Buried
164 N D -1.0595 Soluble
165 S D -0.8074 Soluble
166 G D -0.6028 Soluble
167 A D -0.2665 Soluble
168 L D -0.0407 Soluble
169 T D -0.1582 Soluble
170 S D -0.1520 Soluble
171 G D -0.1826 Soluble
172 V D 0.1993 Aggregation-prone
173 H D -0.2561 Soluble
174 T D -0.1580 Soluble
175 F D 0.0000 Buried
176 P D -0.2787 Soluble
177 A D -0.0135 Soluble
178 V D -0.0110 Soluble
179 L D 0.0645 Aggregation-prone
180 Q D -0.2759 Soluble
181 S D -0.0240 Soluble
182 S D -0.3855 Soluble
183 G D 0.0000 Buried
184 L D -0.3707 Soluble
185 Y D 0.0000 Buried
186 S D 0.0000 Buried
187 L D 0.1672 Aggregation-prone
188 S D 0.0000 Buried
189 S D 0.0000 Buried
190 V D 0.0000 Buried
191 V D 0.0000 Buried
192 T D -0.1397 Soluble
193 V D 0.0000 Buried
194 P D -0.6978 Soluble
195 S D -0.5256 Soluble
196 K D -2.0077 Soluble
197 T D -1.6696 Soluble
198 Y D 0.0000 Buried
199 T D 0.0000 Buried
200 C D 0.0000 Buried
201 N D -1.6883 Soluble
202 V D 0.0000 Buried
203 D D -2.1616 Soluble
204 H D 0.0000 Buried
205 K D -2.9330 Soluble
206 P D -1.8356 Soluble
207 S D -1.8131 Soluble
208 N D -2.5744 Soluble
209 T D -2.0995 Soluble
210 K D -2.7915 Soluble
211 V D -1.7595 Soluble
212 D D -2.7441 Soluble
213 K D -2.2763 Soluble
214 R D -2.7752 Soluble
215 V D 0.0000 Buried
216 H D -2.1617 Soluble
217 H D -1.9727 Soluble
2 S E -0.2846 Soluble
3 A E -0.2558 Soluble
4 L E 0.0000 Buried
5 T E -0.3350 Soluble
6 Q E -0.3655 Soluble
7 P E -0.2573 Soluble
8 A E -0.2638 Soluble
9 S E -0.2965 Soluble
11 V E -0.1181 Soluble
12 S E -0.2789 Soluble
13 G E 0.0000 Buried
14 S E -0.8324 Soluble
15 P E -1.1292 Soluble
16 G E -1.4524 Soluble
17 Q E -1.7851 Soluble
18 S E -1.1792 Soluble
19 I E 0.0000 Buried
20 T E -0.1576 Soluble
21 I E 0.0000 Buried
22 S E -0.2596 Soluble
23 C E 0.0000 Buried
24 T E -0.6266 Soluble
25 A E 0.0000 Buried
26 T E -0.4667 Soluble
27 S E -0.6815 Soluble
28 S E -1.0818 Soluble
29 D E -1.1482 Soluble
30 V E -1.0821 Soluble
31 G E -1.7751 Soluble
35 D E -2.4447 Soluble
36 Y E 0.0000 Buried
37 N E -1.5907 Soluble
38 Y E -0.3111 Soluble
39 V E 0.0000 Buried
40 S E 0.0000 Buried
41 W E 0.0000 Buried
42 Y E 0.0000 Buried
43 Q E 0.0000 Buried
44 Q E 0.0000 Buried
45 H E -1.5495 Soluble
46 P E -1.3048 Soluble
47 G E -1.6300 Soluble
48 K E -2.4652 Soluble
49 A E -1.6783 Soluble
50 P E 0.0000 Buried
51 K E -1.2204 Soluble
52 L E 0.0000 Buried
53 M E 0.0000 Buried
54 I E 0.0000 Buried
55 F E -1.0291 Soluble
56 E E -1.4528 Soluble
57 V E -1.1574 Soluble
65 S E -1.5174 Soluble
66 D E -2.1624 Soluble
67 R E -1.9390 Soluble
68 P E -0.9106 Soluble
69 S E -0.8594 Soluble
70 G E -0.7313 Soluble
71 I E -0.6874 Soluble
72 S E -0.9836 Soluble
74 N E -1.6918 Soluble
75 R E -1.1172 Soluble
76 F E 0.0000 Buried
77 S E -0.9950 Soluble
78 G E -0.9355 Soluble
79 S E -0.9394 Soluble
80 K E -1.2953 Soluble
83 S E -1.0944 Soluble
84 G E -1.4943 Soluble
85 N E -1.9446 Soluble
86 T E -1.0477 Soluble
87 A E 0.0000 Buried
88 S E -0.4153 Soluble
89 L E 0.0000 Buried
90 T E -0.3120 Soluble
91 I E 0.0000 Buried
92 S E -1.1833 Soluble
93 G E -1.1746 Soluble
94 L E 0.0000 Buried
95 Q E -1.6805 Soluble
96 A E -1.3613 Soluble
97 E E -2.1396 Soluble
98 D E 0.0000 Buried
99 E E -1.2387 Soluble
100 A E 0.0000 Buried
101 D E -0.9302 Soluble
102 Y E 0.0000 Buried
103 Y E 0.0000 Buried
104 C E 0.0000 Buried
105 S E 0.0000 Buried
106 S E 0.0000 Buried
107 Y E 0.0650 Aggregation-prone
108 T E -0.4508 Soluble
109 T E -0.3865 Soluble
114 S E -0.4754 Soluble
115 S E -0.2769 Soluble
116 A E 0.0000 Buried
117 V E 0.0793 Aggregation-prone
118 F E 0.0000 Buried
119 G E 0.0000 Buried
120 G E -1.0183 Soluble
121 G E -0.8175 Soluble
122 T E 0.0000 Buried
123 K E -0.8603 Soluble
124 L E 0.0000 Buried
125 T E 0.0000 Buried
126 V E 0.0000 Buried
127 L E -0.0653 Soluble
128 G E -0.4887 Soluble
129 R E -0.5055 Soluble
130 T E 0.4777 Aggregation-prone
131 V E 1.4073 Aggregation-prone
132 A E 0.5403 Aggregation-prone
133 A E 0.2989 Aggregation-prone
134 P E 0.0263 Aggregation-prone
135 S E -0.1691 Soluble
136 V E 0.0000 Buried
137 F E 0.0650 Aggregation-prone
138 I E 0.0588 Aggregation-prone
139 F E 0.0000 Buried
140 P E -0.2363 Soluble
141 P E -0.8279 Soluble
142 S E -1.6015 Soluble
143 D E -3.0476 Soluble
144 E E -3.2176 Soluble
145 Q E 0.0000 Buried
146 L E -2.3893 Soluble
147 K E -2.8875 Soluble
148 S E -1.8044 Soluble
149 G E -1.4882 Soluble
150 T E -1.1447 Soluble
151 A E 0.0000 Buried
152 S E 0.0000 Buried
153 V E 0.0000 Buried
154 V E 0.0000 Buried
155 C E 0.0000 Buried
156 L E 0.0000 Buried
157 L E 0.0000 Buried
158 N E 0.0000 Buried
159 N E -0.8833 Soluble
160 F E 0.0000 Buried
161 Y E 0.0000 Buried
162 P E -0.5748 Soluble
163 R E -1.5866 Soluble
164 E E -1.6367 Soluble
165 A E -1.5220 Soluble
166 K E -2.0623 Soluble
167 V E -0.9853 Soluble
168 Q E -0.6315 Soluble
169 W E 0.0000 Buried
170 K E -0.7647 Soluble
171 V E 0.0000 Buried
172 D E -1.9842 Soluble
173 N E -1.6710 Soluble
174 A E -0.4930 Soluble
175 L E 0.2221 Aggregation-prone
176 Q E -0.4898 Soluble
177 S E -0.7174 Soluble
178 G E -1.2640 Soluble
179 N E -1.5199 Soluble
180 S E -1.4226 Soluble
181 Q E -1.6104 Soluble
182 E E -1.2217 Soluble
183 S E -0.4600 Soluble
184 V E -0.5422 Soluble
185 T E -1.0593 Soluble
186 E E -2.2195 Soluble
187 Q E -2.3256 Soluble
188 D E -2.3901 Soluble
189 S E -2.0115 Soluble
190 K E -2.5399 Soluble
191 D E -2.2538 Soluble
192 S E -2.1151 Soluble
193 T E 0.0000 Buried
194 Y E 0.0000 Buried
195 S E 0.0000 Buried
196 L E 0.0000 Buried
197 S E 0.0000 Buried
198 S E 0.0000 Buried
199 T E -0.6558 Soluble
200 L E 0.0000 Buried
201 T E -0.7299 Soluble
202 L E -0.9070 Soluble
203 S E -1.2076 Soluble
204 K E -2.2785 Soluble
205 A E -2.0552 Soluble
206 D E -2.8568 Soluble
207 Y E 0.0000 Buried
208 E E -3.3823 Soluble
209 K E -3.6029 Soluble
210 H E -3.0835 Soluble
211 K E -3.1386 Soluble
212 V E -1.4298 Soluble
213 Y E 0.0000 Buried
214 A E 0.0000 Buried
215 C E 0.0000 Buried
216 E E -0.6882 Soluble
217 V E 0.0000 Buried
218 T E -0.9234 Soluble
219 Q E -0.8095 Soluble
220 G E -0.7031 Soluble
221 T E -0.4268 Soluble
222 T E -0.2699 Soluble
223 S E -0.3892 Soluble
224 V E 0.1069 Aggregation-prone
225 T E -0.3875 Soluble
226 K E -0.7311 Soluble
227 S E -0.5650 Soluble
228 F E 0.0000 Buried
229 N E -1.8007 Soluble
230 R E -2.2454 Soluble
231 G E -1.8884 Soluble
232 E E -2.1714 Soluble
233 C E -0.4650 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 -0.666 2.0779 CSV PDB
4.5 -0.7131 2.0209 CSV PDB
5.0 -0.765 1.9617 CSV PDB
5.5 -0.8118 1.9017 CSV PDB
6.0 -0.8428 1.8417 CSV PDB
6.5 -0.8507 1.8237 CSV PDB
7.0 -0.8382 1.8237 CSV PDB
7.5 -0.814 1.8237 CSV PDB
8.0 -0.7835 1.8237 CSV PDB
8.5 -0.7466 1.8237 CSV PDB
9.0 -0.7016 1.8908 CSV PDB
Average A4D Score vs pH
Max A4D Score vs pH