Suvratoxumab / 4u6v

A4DAB251_4u6v_H_L | Source PDB: 4u6v | Chains: H, L | Done
100
Yes
10 Å
Yes
Avg A4D Score
-0.6913
Max Score
1.4916
Min Score
-3.8103
Total Score
-297.95
Score CDR
-0.4103
Score non-CDR
-0.7265

Calculation Parameters

Chain Sequence(s) EVQLVESGGGLVQPGGSLRLSCAASGFTFSSHDMHWVRQATGKGLEWVSGIGTAGDTYYPDSVKGRFTISRENAKNSLYLQMNSLRAGDTAVYYCARDRYSPTGHYYGMDVWGQGTTVTVSSASTKGPSVFPLAPSSGGTAALGCLVKDYFPEPVTVSWNSGALTSGVHTFPAVLQSSGLYSLSSVVTVPSSSLGTQTYICNVNHKPSNTKVDKRVEPDIQMTQSPSTLSASVGDRVTITCRASQSISSWLAWYQQKPGKAPKLLIYKASSLESGVPSRFSGSGSGTEFTLTISSLQPDDFATYYCKQYADYWTFGQGTKVEIKRTVAAPSVFIFPPSDEQLKSGTASVVCLLNNFYPREAKVQWKVDNALQSGNSQESVTEQDSKDSTYSLSSTLTLSKADYEKHKVYACEVTHQGLSSPVTKSFNRGEC 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 -3.8103
Maximum Score 1.4916
Average Score -0.6913
Total Score -297.9493

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

Index Residue Chain A4D Score Classification
1 E H -1.9271 Soluble
2 V H -0.9355 Soluble
3 Q H -0.9048 Soluble
4 L H 0.0000 Buried
5 V H 0.6109 Aggregation-prone
6 E H 0.0000 Buried
7 S H -0.5771 Soluble
8 G H -1.0485 Soluble
9 G H -0.6896 Soluble
11 G H -0.1143 Soluble
12 L H 0.4736 Aggregation-prone
13 V H 0.0000 Buried
14 Q H -1.6158 Soluble
15 P H -1.7208 Soluble
16 G H -1.5139 Soluble
17 G H 0.0000 Buried
18 S H -1.3034 Soluble
19 L H -0.9690 Soluble
20 R H -2.0772 Soluble
21 L H 0.0000 Buried
22 S H -0.4307 Soluble
23 C H 0.0000 Buried
24 A H -0.2064 Soluble
25 A H 0.0000 Buried
26 S H -0.7672 Soluble
27 G H -1.0257 Soluble
28 F H -0.4121 Soluble
29 T H -0.3008 Soluble
30 F H 0.0000 Buried
35 S H -0.7892 Soluble
36 S H -0.4710 Soluble
37 H H -0.3291 Soluble
38 D H -0.5132 Soluble
39 M H 0.0000 Buried
40 H H 0.0000 Buried
41 W H 0.0000 Buried
42 V H 0.0000 Buried
43 R H 0.0000 Buried
44 Q H -0.7506 Soluble
45 A H -0.8417 Soluble
46 T H -0.8556 Soluble
47 G H -1.4132 Soluble
48 K H -2.2703 Soluble
49 G H -1.5351 Soluble
50 L H 0.0000 Buried
51 E H -1.0561 Soluble
52 W H 0.0000 Buried
53 V H 0.0000 Buried
54 S H 0.0000 Buried
55 G H 0.0000 Buried
56 I H 0.0000 Buried
57 G H 0.0000 Buried
58 T H -0.6987 Soluble
59 A H -0.6696 Soluble
63 G H -1.2159 Soluble
64 D H -1.5886 Soluble
65 T H -0.7332 Soluble
66 Y H -0.2376 Soluble
67 Y H -0.5928 Soluble
68 P H -1.4806 Soluble
69 D H -2.8622 Soluble
70 S H -1.6978 Soluble
71 V H 0.0000 Buried
72 K H -2.6982 Soluble
74 G H -1.8408 Soluble
75 R H -1.5995 Soluble
76 F H 0.0000 Buried
77 T H -0.7618 Soluble
78 I H 0.0000 Buried
79 S H -0.6927 Soluble
80 R H -1.3949 Soluble
81 E H -2.0179 Soluble
82 N H -2.0439 Soluble
83 A H -1.6138 Soluble
84 K H -2.5046 Soluble
85 N H -2.0367 Soluble
86 S H 0.0000 Buried
87 L H 0.0000 Buried
88 Y H -0.4969 Soluble
89 L H 0.0000 Buried
90 Q H -1.0722 Soluble
91 M H 0.0000 Buried
92 N H -1.4585 Soluble
93 S H -1.3376 Soluble
94 L H 0.0000 Buried
95 R H -2.4714 Soluble
96 A H -1.3471 Soluble
97 G H -1.0926 Soluble
98 D H 0.0000 Buried
99 T H -0.3716 Soluble
100 A H 0.0000 Buried
101 V H 0.1778 Aggregation-prone
102 Y H 0.0000 Buried
103 Y H 0.0000 Buried
104 C H 0.0000 Buried
105 A H 0.0000 Buried
106 R H 0.0000 Buried
107 D H 0.0000 Buried
108 R H -0.2950 Soluble
109 Y H 0.1085 Aggregation-prone
110 S H -0.1772 Soluble
111 P H -0.3903 Soluble
111A T H -0.4030 Soluble
112B G H -0.5462 Soluble
112A H H -0.4939 Soluble
112 Y H 0.0033 Aggregation-prone
113 Y H 0.0167 Aggregation-prone
114 G H 0.0000 Buried
115 M H 0.0000 Buried
116 D H -0.6043 Soluble
117 V H -0.3215 Soluble
118 W H 0.0000 Buried
119 G H 0.0000 Buried
120 Q H -1.4500 Soluble
121 G H -0.6765 Soluble
122 T H -0.2649 Soluble
123 T H 0.0196 Aggregation-prone
124 V H 0.0000 Buried
125 T H -0.3302 Soluble
126 V H 0.0000 Buried
127 S H -0.8885 Soluble
128 S H -0.8354 Soluble
129 A H -0.5077 Soluble
130 S H -0.6194 Soluble
131 T H -0.7528 Soluble
132 K H -1.4510 Soluble
133 G H -1.5261 Soluble
134 P H 0.0000 Buried
135 S H -0.4178 Soluble
136 V H 0.0000 Buried
137 F H 0.0000 Buried
138 P H -1.1545 Soluble
139 L H 0.0000 Buried
140 A H -0.8357 Soluble
141 P H 0.0000 Buried
142 S H -0.5327 Soluble
143 S H -0.6678 Soluble
144 G H -0.8593 Soluble
145 G H -0.8694 Soluble
146 T H -0.6150 Soluble
147 A H 0.0000 Buried
148 A H 0.0000 Buried
149 L H 0.0000 Buried
150 G H 0.0000 Buried
151 C H 0.0000 Buried
152 L H 0.0000 Buried
153 V H 0.0000 Buried
154 K H 0.0000 Buried
155 D H -0.2784 Soluble
156 Y H 0.0000 Buried
157 F H 0.0000 Buried
158 P H -0.7399 Soluble
159 E H -1.1540 Soluble
160 P H -1.1767 Soluble
161 V H -0.9764 Soluble
162 T H -0.7870 Soluble
163 V H -0.2269 Soluble
164 S H -0.4423 Soluble
165 W H 0.0000 Buried
166 N H -0.8052 Soluble
167 S H -0.6906 Soluble
168 G H -0.6041 Soluble
169 A H -0.2758 Soluble
170 L H -0.0232 Soluble
171 T H -0.1675 Soluble
172 S H -0.1603 Soluble
173 G H -0.1930 Soluble
174 V H 0.2411 Aggregation-prone
175 H H -0.0415 Soluble
176 T H 0.0675 Aggregation-prone
177 F H 0.0000 Buried
178 P H -0.2804 Soluble
179 A H 0.4054 Aggregation-prone
180 V H 0.7868 Aggregation-prone
181 L H 1.4916 Aggregation-prone
182 Q H 0.5241 Aggregation-prone
183 S H 0.0460 Aggregation-prone
184 S H -0.1347 Soluble
185 G H 0.1583 Aggregation-prone
186 L H 0.1257 Aggregation-prone
187 Y H 0.4565 Aggregation-prone
188 S H 0.0000 Buried
189 L H 0.0000 Buried
190 S H 0.0000 Buried
191 S H 0.0000 Buried
192 V H 0.0000 Buried
193 V H 0.0000 Buried
194 T H -0.1237 Soluble
195 V H 0.0000 Buried
196 P H -0.4624 Soluble
197 S H -0.5597 Soluble
198 S H -0.5916 Soluble
199 S H -0.6234 Soluble
200 L H -0.8326 Soluble
201 G H -0.9815 Soluble
202 T H -0.7902 Soluble
203 Q H -1.1901 Soluble
204 T H -1.2141 Soluble
205 Y H 0.0000 Buried
206 I H -1.2778 Soluble
207 C H 0.0000 Buried
208 N H -1.6256 Soluble
209 V H 0.0000 Buried
210 N H -2.3505 Soluble
211 H H 0.0000 Buried
212 K H -2.8921 Soluble
213 P H -1.7936 Soluble
214 S H -1.9588 Soluble
215 N H -2.6556 Soluble
216 T H -2.2297 Soluble
217 K H -2.8478 Soluble
218 V H -1.6722 Soluble
219 D H -2.6214 Soluble
220 K H -2.1112 Soluble
221 R H -2.7616 Soluble
222 V H 0.0000 Buried
223 E H -2.4508 Soluble
224 P H -1.2145 Soluble
1 D L -2.6400 Soluble
2 I L 0.0000 Buried
3 Q L -2.3659 Soluble
4 M L 0.0000 Buried
5 T L -1.4390 Soluble
6 Q L 0.0000 Buried
7 S L -0.8126 Soluble
8 P L -0.4517 Soluble
9 S L -0.7172 Soluble
10 T L -0.5055 Soluble
11 L L -0.3137 Soluble
12 S L -0.6729 Soluble
13 A L 0.0000 Buried
14 S L -0.5708 Soluble
15 V L 0.2270 Aggregation-prone
16 G L -0.8957 Soluble
17 D L -1.9434 Soluble
18 R L -2.4756 Soluble
19 V L 0.0000 Buried
20 T L -0.6323 Soluble
21 I L 0.0000 Buried
22 T L -0.8418 Soluble
23 C L 0.0000 Buried
24 R L -2.8038 Soluble
25 A L 0.0000 Buried
26 S L -2.0665 Soluble
27 Q L -2.2203 Soluble
28 S L -1.2860 Soluble
29 I L 0.0000 Buried
36 S L -0.5987 Soluble
37 S L -0.5039 Soluble
38 W L -0.1112 Soluble
39 L L 0.0000 Buried
40 A 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 0.0000 Buried
45 K L -1.6692 Soluble
46 P L -1.4947 Soluble
47 G L -1.7216 Soluble
48 K L -2.5621 Soluble
49 A L -1.6124 Soluble
50 P L 0.0000 Buried
51 K L -1.5653 Soluble
52 L L 0.0000 Buried
53 L L 0.0000 Buried
54 I L 0.0000 Buried
55 Y L 0.0000 Buried
56 K L -0.8366 Soluble
57 A L 0.0000 Buried
65 S L -0.5060 Soluble
66 S L -0.2696 Soluble
67 L L 0.0493 Aggregation-prone
68 E L -0.3930 Soluble
69 S L -0.4227 Soluble
70 G L -0.7201 Soluble
71 V L 0.0000 Buried
72 P L -0.4181 Soluble
74 S L -0.4700 Soluble
75 R L -0.8305 Soluble
76 F L 0.0000 Buried
77 S L -0.2935 Soluble
78 G L -0.3915 Soluble
79 S L -0.7496 Soluble
80 G L -1.0946 Soluble
83 S L -0.8510 Soluble
84 G L -1.1343 Soluble
85 T L -1.7849 Soluble
86 E L -2.2233 Soluble
87 F L 0.0000 Buried
88 T L -0.7311 Soluble
89 L L 0.0000 Buried
90 T L -0.5929 Soluble
91 I L 0.0000 Buried
92 S L -1.3614 Soluble
93 S L -1.2218 Soluble
94 L L 0.0000 Buried
95 Q L -1.1366 Soluble
96 P L -0.8538 Soluble
97 D L -1.8541 Soluble
98 D L 0.0000 Buried
99 F L -0.3076 Soluble
100 A L 0.0000 Buried
101 T L -0.6770 Soluble
102 Y L 0.0000 Buried
103 Y L 0.0000 Buried
104 C L 0.0000 Buried
105 K L 0.0000 Buried
106 Q L 0.0000 Buried
107 Y L 0.0500 Aggregation-prone
108 A L -0.3329 Soluble
114 D L -1.2436 Soluble
115 Y L 0.3387 Aggregation-prone
116 W L 0.0761 Aggregation-prone
117 T L -0.6676 Soluble
118 F L 0.0000 Buried
119 G L 0.0000 Buried
120 Q L -1.4885 Soluble
121 G L -1.0746 Soluble
122 T L 0.0000 Buried
123 K L -0.9858 Soluble
124 V L 0.0000 Buried
125 E L 0.0000 Buried
126 I L -0.1408 Soluble
127 K L -1.3712 Soluble
128 R L -1.1830 Soluble
129 T L -0.2737 Soluble
130 V L 0.2793 Aggregation-prone
131 A L 0.0236 Aggregation-prone
132 A L -0.1567 Soluble
133 P L 0.0000 Buried
134 S L -0.2519 Soluble
135 V L 0.0000 Buried
136 F L 0.0011 Aggregation-prone
137 I L 0.1536 Aggregation-prone
138 F L 0.0000 Buried
139 P L -0.2707 Soluble
140 P L 0.0000 Buried
141 S L -1.3920 Soluble
142 D L -2.6969 Soluble
143 E L -2.6958 Soluble
144 Q L 0.0000 Buried
145 L L -2.1519 Soluble
146 K L -2.7238 Soluble
147 S L -1.7179 Soluble
148 G L -1.1140 Soluble
149 T L -0.8055 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 -0.3456 Soluble
158 N L -0.6899 Soluble
159 F L 0.0000 Buried
160 Y L 0.0000 Buried
161 P L -1.3024 Soluble
162 R L -1.9709 Soluble
163 E L -2.7194 Soluble
164 A L -2.0760 Soluble
165 K L -2.2204 Soluble
166 V L -1.1497 Soluble
167 Q L -0.6129 Soluble
168 W L 0.0000 Buried
169 K L -0.6132 Soluble
170 V L 0.0000 Buried
171 D L -1.9180 Soluble
172 N L -1.3418 Soluble
173 A L -0.2982 Soluble
174 L L 0.6306 Aggregation-prone
175 Q L -0.4456 Soluble
176 S L -0.7426 Soluble
177 G L -1.3211 Soluble
178 N L -1.6331 Soluble
179 S L -1.4465 Soluble
180 Q L -1.3188 Soluble
181 E L -1.7907 Soluble
182 S L -0.6849 Soluble
183 V L -0.4953 Soluble
184 T L -0.9740 Soluble
185 E L -2.0718 Soluble
186 Q L -1.6048 Soluble
187 D L -1.8638 Soluble
188 S L -1.6755 Soluble
189 K L -2.1504 Soluble
190 D L -1.5461 Soluble
191 S L -1.5614 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 -0.7195 Soluble
199 L L 0.0000 Buried
200 T L -0.6229 Soluble
201 L L -0.9417 Soluble
202 S L -1.1838 Soluble
203 K L -2.2277 Soluble
204 A L -2.0416 Soluble
205 D L -2.9952 Soluble
206 Y L 0.0000 Buried
207 E L -3.7364 Soluble
208 K L -3.8103 Soluble
209 H L -3.0872 Soluble
210 K L -2.9846 Soluble
211 V L -1.6860 Soluble
212 Y L 0.0000 Buried
213 A L -0.6062 Soluble
214 C L 0.0000 Buried
215 E L -0.6749 Soluble
216 V L 0.0000 Buried
217 T L -1.2392 Soluble
218 H L 0.0000 Buried
219 Q L -1.5020 Soluble
220 G L -0.4692 Soluble
221 L L -0.2899 Soluble
222 S L -0.4854 Soluble
223 S L -0.4468 Soluble
224 P L -0.6014 Soluble
225 V L 0.0135 Aggregation-prone
226 T L -0.4024 Soluble
227 K L -0.5924 Soluble
228 S L -0.4545 Soluble
229 F L -0.7394 Soluble
230 N L -1.8087 Soluble
231 R L -2.1548 Soluble
232 G L -1.8665 Soluble
233 E L -1.9400 Soluble
234 C L -0.7807 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 -0.6734 2.1809 CSV PDB
4.5 -0.7159 2.01 CSV PDB
5.0 -0.7655 1.8117 CSV PDB
5.5 -0.8126 1.7155 CSV PDB
6.0 -0.8475 1.6809 CSV PDB
6.5 -0.8623 1.6849 CSV PDB
7.0 -0.8564 1.691 CSV PDB
7.5 -0.8365 1.6933 CSV PDB
8.0 -0.8086 1.694 CSV PDB
8.5 -0.7742 1.6943 CSV PDB
9.0 -0.7331 1.6942 CSV PDB
Average A4D Score vs pH
Max A4D Score vs pH