Sarilumab / 8iow

A4DAB234_8iow_H_L | Source PDB: 8iow | Chains: H, L | Done
100
Yes
10 Å
Yes
Avg A4D Score
-0.7434
Max Score
1.4549
Min Score
-3.6669
Total Score
-311.48
Score CDR
-0.7916
Score non-CDR
-0.7379

Calculation Parameters

Chain Sequence(s) VQLVESGGGLVQPGRSLRLSCAASRFTFDDYAMHWVRQAPGKGLEWVSGISWNSGRIGYADSVKGRFTISRDNAENSLFLQMNGLRAEDTALYYCAKGRDSFDIWGQGTMVTVSSASTKGPSVFPLAPTAALGCLVKDYFPEPVTVSWNSGALTSGVHTFPAVLQSSGLYSLSSVVTVPSSSLGTQTYICNVNHKPSNTKVDKKVEPDIQMTQSPSSVSASVGDRVTITCRASQGISSWLAWYQQKPGKAPKLLIYGASSLESGVPSRFSGSGSGTDFTLTISSLQPEDFASYYCQQANSFPYTFGQGTKLEIKRTVAAPSVFIFPPSDEQLKSGTASVVCLLNNFYPREAKVQWKVDNALQSGNSQESVTEQDSKDSTYSLSSTLTLSKADYEKHKVYACEVTHQGLSSPVTKSFNRG 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 -3.6669
Maximum Score 1.4549
Average Score -0.7434
Total Score -311.4773

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

Index Residue Chain A4D Score Classification
2 V H 0.9088 Aggregation-prone
3 Q H 0.1307 Aggregation-prone
4 L H 0.0000 Buried
5 V H 0.5985 Aggregation-prone
6 E H 0.0000 Buried
7 S H -0.5292 Soluble
8 G H -0.9271 Soluble
9 G H -0.4152 Soluble
11 G H 0.0358 Aggregation-prone
12 L H 0.6166 Aggregation-prone
13 V H 0.0000 Buried
14 Q H -1.7819 Soluble
15 P H -2.1609 Soluble
16 G H -2.2602 Soluble
17 R H -2.8829 Soluble
18 S H -2.2480 Soluble
19 L H -1.4942 Soluble
20 R H -1.9251 Soluble
21 L H 0.0000 Buried
22 S H -0.4138 Soluble
23 C H 0.0000 Buried
24 A H -0.3364 Soluble
25 A H -0.3810 Soluble
26 S H -0.5722 Soluble
27 R H -1.3265 Soluble
28 F H -0.7108 Soluble
29 T H -1.2499 Soluble
30 F H 0.0000 Buried
35 D H -2.9304 Soluble
36 D H -2.3075 Soluble
37 Y H -1.1024 Soluble
38 A H 0.0000 Buried
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 -0.8542 Soluble
45 A H -1.1579 Soluble
46 P H -0.8635 Soluble
47 G H -1.4385 Soluble
48 K H -2.3943 Soluble
49 G H -1.7362 Soluble
50 L H 0.0000 Buried
51 E H -1.4635 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 S H -0.9883 Soluble
58 W H -1.0810 Soluble
59 N H -1.7441 Soluble
62 S H -0.9628 Soluble
63 G H -1.1654 Soluble
64 R H -1.3147 Soluble
65 I H 0.0965 Aggregation-prone
66 G H -0.4116 Soluble
67 Y H -0.7945 Soluble
68 A H 0.0000 Buried
69 D H -2.7308 Soluble
70 S H -1.7467 Soluble
71 V H 0.0000 Buried
72 K H -2.5676 Soluble
74 G H -1.7817 Soluble
75 R H -1.5615 Soluble
76 F H 0.0000 Buried
77 T H -0.8246 Soluble
78 I H 0.0000 Buried
79 S H -0.4388 Soluble
80 R H 0.0000 Buried
81 D H -2.1890 Soluble
82 N H -2.4040 Soluble
83 A H -1.7720 Soluble
84 E H -2.6764 Soluble
85 N H -2.1797 Soluble
86 S H 0.0000 Buried
87 L H 0.0000 Buried
88 F H 0.0000 Buried
89 L H 0.0000 Buried
90 Q H -1.4190 Soluble
91 M H 0.0000 Buried
92 N H -2.2010 Soluble
93 G H -1.9866 Soluble
94 L H 0.0000 Buried
95 R H -2.7944 Soluble
96 A H -1.8104 Soluble
97 E H -2.2949 Soluble
98 D H 0.0000 Buried
99 T H -0.6059 Soluble
100 A H 0.0000 Buried
101 L H 0.0950 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 K H -0.8452 Soluble
107 G H -1.3750 Soluble
108 R H -2.0321 Soluble
109 D H -1.2745 Soluble
114 S H -0.8507 Soluble
115 F H 0.0000 Buried
116 D H -1.6315 Soluble
117 I H -0.3258 Soluble
118 W H 0.0000 Buried
119 G H 0.0000 Buried
120 Q H -1.3392 Soluble
121 G H -0.5609 Soluble
122 T H -0.1397 Soluble
123 M H 0.1904 Aggregation-prone
124 V H 0.0000 Buried
125 T H 0.0000 Buried
126 V H 0.0000 Buried
127 S H 0.0000 Buried
128 S H -0.7061 Soluble
129 A H -0.4128 Soluble
130 S H -0.5072 Soluble
131 T H -0.6678 Soluble
132 K H -1.2138 Soluble
133 G H -1.4141 Soluble
134 P H 0.0000 Buried
135 S H -0.3736 Soluble
136 V H 0.0000 Buried
137 F H 0.0000 Buried
138 P H -1.1455 Soluble
139 L H 0.0000 Buried
140 A H -0.9117 Soluble
141 P H -0.4958 Soluble
142 T H -0.2673 Soluble
143 A H -0.1436 Soluble
144 A H 0.0000 Buried
145 L H 0.0000 Buried
146 G H 0.0000 Buried
147 C H 0.0000 Buried
148 L H 0.0000 Buried
149 V H 0.0000 Buried
150 K H 0.0000 Buried
151 D H -0.4452 Soluble
152 Y H 0.0000 Buried
153 F H 0.0000 Buried
154 P H 0.0000 Buried
155 E H -0.3715 Soluble
156 P H -0.7583 Soluble
157 V H -0.5399 Soluble
158 T H -0.4290 Soluble
159 V H -0.2519 Soluble
160 S H -0.1887 Soluble
161 W H 0.0000 Buried
162 N H -0.6742 Soluble
163 S H -0.5870 Soluble
164 G H -0.4337 Soluble
165 A H -0.1593 Soluble
166 L H 0.0518 Aggregation-prone
167 T H -0.0785 Soluble
168 S H -0.3465 Soluble
169 G H -0.4692 Soluble
170 V H 0.1691 Aggregation-prone
171 H H 0.0000 Buried
172 T H 0.0506 Aggregation-prone
173 F H 0.0000 Buried
174 P H -0.3862 Soluble
175 A H 0.2075 Aggregation-prone
176 V H 0.5469 Aggregation-prone
177 L H 1.4549 Aggregation-prone
178 Q H 0.4021 Aggregation-prone
179 S H 0.0122 Aggregation-prone
180 S H -0.1615 Soluble
181 G H 0.1302 Aggregation-prone
182 L H 0.1314 Aggregation-prone
183 Y H 0.4886 Aggregation-prone
184 S H 0.0000 Buried
185 L H 0.0000 Buried
186 S H 0.0000 Buried
187 S H 0.0000 Buried
188 V H 0.0000 Buried
189 V H 0.0000 Buried
190 T H -0.0966 Soluble
191 V H 0.0000 Buried
192 P H -0.3720 Soluble
193 S H -0.4040 Soluble
194 S H -0.5156 Soluble
195 S H -0.5529 Soluble
196 L H -0.7544 Soluble
197 G H -0.9335 Soluble
198 T H -0.6716 Soluble
199 Q H -1.0715 Soluble
200 T H -1.0489 Soluble
201 Y H 0.0000 Buried
202 I H -1.3309 Soluble
203 C H 0.0000 Buried
204 N H -1.4912 Soluble
205 V H 0.0000 Buried
206 N H -2.0961 Soluble
207 H H 0.0000 Buried
208 K H -2.7432 Soluble
209 P H -1.7174 Soluble
210 S H -1.8647 Soluble
211 N H -2.5538 Soluble
212 T H -2.2767 Soluble
213 K H -2.8204 Soluble
214 V H -1.7795 Soluble
215 D H -2.6655 Soluble
216 K H -2.2393 Soluble
217 K H -2.5619 Soluble
218 V H 0.0000 Buried
219 E H -2.4712 Soluble
220 P H -1.1933 Soluble
1 D L -2.6140 Soluble
2 I L 0.0000 Buried
3 Q L -2.1689 Soluble
4 M L 0.0000 Buried
5 T L -1.1298 Soluble
6 Q L 0.0000 Buried
7 S L -0.5190 Soluble
8 P L -0.4903 Soluble
9 S L -0.7536 Soluble
10 S L -0.6894 Soluble
11 V L -0.1823 Soluble
12 S L -0.7019 Soluble
13 A L 0.0000 Buried
14 S L -0.6630 Soluble
15 V L 0.1886 Aggregation-prone
16 G L -1.1190 Soluble
17 D L -2.3925 Soluble
18 R L -2.6309 Soluble
19 V L 0.0000 Buried
20 T L -0.4874 Soluble
21 I L 0.0000 Buried
22 T L -0.6850 Soluble
23 C L 0.0000 Buried
24 R L -1.9521 Soluble
25 A L -1.7358 Soluble
26 S L -1.8761 Soluble
27 Q L -2.1868 Soluble
28 G L -1.5973 Soluble
29 I L 0.0000 Buried
36 S L -0.8372 Soluble
37 S L -0.3612 Soluble
38 W L 0.2504 Aggregation-prone
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 -1.7206 Soluble
46 P L -1.5173 Soluble
47 G L -1.6790 Soluble
48 K L -2.5757 Soluble
49 A L -1.6951 Soluble
50 P L 0.0000 Buried
51 K L -1.8766 Soluble
52 L L 0.0000 Buried
53 L L 0.0000 Buried
54 I L 0.0000 Buried
55 Y L 0.7510 Aggregation-prone
56 G L 0.4189 Aggregation-prone
57 A L 0.0000 Buried
65 S L -0.0179 Soluble
66 S L 0.2243 Aggregation-prone
67 L L 0.3775 Aggregation-prone
68 E L -0.4518 Soluble
69 S L -0.6316 Soluble
70 G L -0.5589 Soluble
71 V L -0.4092 Soluble
72 P L -0.3463 Soluble
74 S L -0.4057 Soluble
75 R L -0.6857 Soluble
76 F L 0.0000 Buried
77 S L -0.2463 Soluble
78 G L -0.1215 Soluble
79 S L -0.7074 Soluble
80 G L -1.0193 Soluble
83 S L -1.0230 Soluble
84 G L -1.2642 Soluble
85 T L -1.8056 Soluble
86 D L -2.3682 Soluble
87 F L 0.0000 Buried
88 T L -0.7291 Soluble
89 L L 0.0000 Buried
90 T L -0.6002 Soluble
91 I L 0.0000 Buried
92 S L -1.4970 Soluble
93 S L -1.3942 Soluble
94 L L 0.0000 Buried
95 Q L -1.1475 Soluble
96 P L -0.8134 Soluble
97 E L -1.6925 Soluble
98 D L 0.0000 Buried
99 F L -0.4630 Soluble
100 A L 0.0000 Buried
101 S L -0.8548 Soluble
102 Y L 0.0000 Buried
103 Y L 0.0000 Buried
104 C L 0.0000 Buried
105 Q L 0.0000 Buried
106 Q L 0.0000 Buried
107 A L 0.0000 Buried
108 N L -0.9024 Soluble
109 S L -0.7923 Soluble
114 F L -0.5795 Soluble
115 P L -1.0448 Soluble
116 Y L 0.0000 Buried
117 T L -1.2654 Soluble
118 F L 0.0000 Buried
119 G L 0.0000 Buried
120 Q L -1.9627 Soluble
121 G L -1.2887 Soluble
122 T L 0.0000 Buried
123 K L -1.1650 Soluble
124 L L 0.0000 Buried
125 E L -0.9454 Soluble
126 I L -0.3680 Soluble
127 K L -1.1475 Soluble
128 R L -1.1600 Soluble
129 T L -0.2619 Soluble
130 V L 0.5889 Aggregation-prone
131 A L 0.1541 Aggregation-prone
132 A L -0.1487 Soluble
133 P L 0.0000 Buried
134 S L -0.1761 Soluble
135 V L 0.0000 Buried
136 F L 0.0765 Aggregation-prone
137 I L 0.0883 Aggregation-prone
138 F L 0.0000 Buried
139 P L -0.6515 Soluble
140 P L 0.0000 Buried
141 S L -1.3888 Soluble
142 D L -2.6022 Soluble
143 E L -2.1357 Soluble
144 Q L 0.0000 Buried
145 L L -2.0446 Soluble
146 K L -2.6067 Soluble
147 S L -1.5701 Soluble
148 G L -1.3173 Soluble
149 T L -0.9495 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 0.0000 Buried
158 N L -1.0225 Soluble
159 F L 0.0000 Buried
160 Y L 0.0000 Buried
161 P L -1.6135 Soluble
162 R L -2.9128 Soluble
163 E L -3.1264 Soluble
164 A L -2.2766 Soluble
165 K L -2.5801 Soluble
166 V L -1.0685 Soluble
167 Q L -0.3955 Soluble
168 W L 0.0000 Buried
169 K L -0.7788 Soluble
170 V L 0.0000 Buried
171 D L -2.2967 Soluble
172 N L -1.7361 Soluble
173 A L -0.3729 Soluble
174 L L 0.6346 Aggregation-prone
175 Q L -0.2890 Soluble
176 S L -0.4115 Soluble
177 G L -0.7511 Soluble
178 N L -0.7564 Soluble
179 S L -1.2073 Soluble
180 Q L -1.4793 Soluble
181 E L -2.1722 Soluble
182 S L -0.8673 Soluble
183 V L -0.8128 Soluble
184 T L -1.1292 Soluble
185 E L -2.3097 Soluble
186 Q L -2.1761 Soluble
187 D L -2.4750 Soluble
188 S L -2.1632 Soluble
189 K L -2.9651 Soluble
190 D L -3.0147 Soluble
191 S L -2.3320 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 -0.7482 Soluble
199 L L 0.0000 Buried
200 T L -0.5124 Soluble
201 L L 0.0000 Buried
202 S L -1.3428 Soluble
203 K L -2.1958 Soluble
204 A L -1.9907 Soluble
205 D L -2.5096 Soluble
206 Y L 0.0000 Buried
207 E L -3.6669 Soluble
208 K L -3.6193 Soluble
209 H L -3.2358 Soluble
210 K L -3.4288 Soluble
211 V L -2.0369 Soluble
212 Y L 0.0000 Buried
213 A L 0.0000 Buried
214 C L 0.0000 Buried
215 E L -0.5863 Soluble
216 V L 0.0000 Buried
217 T L -1.2117 Soluble
218 H L 0.0000 Buried
219 Q L -1.7374 Soluble
220 G L -0.4725 Soluble
221 L L -0.2586 Soluble
222 S L -0.4805 Soluble
223 S L -0.3969 Soluble
224 P L -0.5195 Soluble
225 V L 0.0787 Aggregation-prone
226 T L -0.4147 Soluble
227 K L -0.7928 Soluble
228 S L -0.7616 Soluble
229 F L -1.1576 Soluble
230 N L -2.3011 Soluble
231 R L -2.3224 Soluble
232 G L -1.4150 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 -0.6455 2.172 CSV PDB
4.5 -0.6934 2.0206 CSV PDB
5.0 -0.7517 1.8032 CSV PDB
5.5 -0.8106 1.7058 CSV PDB
6.0 -0.8594 1.6834 CSV PDB
6.5 -0.8887 1.6636 CSV PDB
7.0 -0.897 1.6468 CSV PDB
7.5 -0.8899 1.6491 CSV PDB
8.0 -0.8739 1.7489 CSV PDB
8.5 -0.8509 1.8495 CSV PDB
9.0 -0.8193 1.9476 CSV PDB
Average A4D Score vs pH
Max A4D Score vs pH