Rozanolixizumab / 6fgb

A4DAB229_6fgb_H_L | Source PDB: 6fgb | Chains: H, L | Done
100
Yes
10 Å
Yes
Avg A4D Score
-0.6976
Max Score
2.4699
Min Score
-3.7132
Total Score
-304.17
Score CDR
-0.3727
Score non-CDR
-0.7388

Calculation Parameters

Chain Sequence(s) VPLVESGGGLVQPGGSLRLSCAVSGFTFSNYGMVWVRQAPGKGLEWVAYIDSDGDNTYYRDSVKGRFTISRDNAKSSLYLQMNSLRAEDTAVYYCTTGIVRPFLYWGQGTLVTVSSASTKGPSVFPLAPSSKSTSGGTAALGCLVKDYFPEPVTVSWNSGALTSGVHTFPAVLQSSGLYSLSSVVTVPSSSLGTQTYICNVNHKPSNTKVDKKVEPKDIQMTQSPSSLSASVGDRVTITCKSSQSLVGASGKTYLYWLFQKPGKAPKRLIYLVSTLDSGIPSRFSGSGSGTEFTLTISSLQPEDFATYYCLQGTHFPHTFGQGTKLEIKRTVAAPSVFIFPPSDEQLKSGTASVVCLLNNFYPREAKVQWKVDNALQSGNSQESVTEQDSKDSTYSLSSTLTLSKADYEKHKVYACEVTHQGLSSPVTKSFNRGEC 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 -3.7132
Maximum Score 2.4699
Average Score -0.6976
Total Score -304.1665

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

Index Residue Chain A4D Score Classification
2 V H 1.8341 Aggregation-prone
3 P H 0.8673 Aggregation-prone
4 L H 0.0000 Buried
5 V H 1.7072 Aggregation-prone
6 E H 0.0000 Buried
7 S H -0.2738 Soluble
8 G H -0.8283 Soluble
9 G H -0.2965 Soluble
11 G H 0.0454 Aggregation-prone
12 L H 0.3231 Aggregation-prone
13 V H -0.5264 Soluble
14 Q H -1.6361 Soluble
15 P H -1.7826 Soluble
16 G H -1.5491 Soluble
17 G H -1.0770 Soluble
18 S H -1.0582 Soluble
19 L H -1.0175 Soluble
20 R H -2.1153 Soluble
21 L H 0.0000 Buried
22 S H -0.3671 Soluble
23 C H 0.0000 Buried
24 A H 0.1508 Aggregation-prone
25 V H 0.0000 Buried
26 S H -0.0207 Soluble
27 G H 0.1433 Aggregation-prone
28 F H -0.2993 Soluble
29 T H -0.5888 Soluble
30 F H 0.0000 Buried
35 S H -1.6711 Soluble
36 N H -1.1777 Soluble
37 Y H 0.0000 Buried
38 G H 0.0000 Buried
39 M H 0.0000 Buried
40 V 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 -0.7628 Soluble
45 A H -1.1317 Soluble
46 P H -0.9049 Soluble
47 G H -1.5140 Soluble
48 K H -2.3259 Soluble
49 G H -1.5809 Soluble
50 L H 0.0000 Buried
51 E H -0.9793 Soluble
52 W H 0.0000 Buried
53 V H 0.0000 Buried
54 A H 0.0000 Buried
55 Y H 0.0000 Buried
56 I H 0.0000 Buried
57 D H -2.0371 Soluble
58 S H -2.0400 Soluble
59 D H -3.2007 Soluble
62 G H -2.7761 Soluble
63 D H -3.2214 Soluble
64 N H -2.5832 Soluble
65 T H -0.9024 Soluble
66 Y H -0.0860 Soluble
67 Y H -0.6801 Soluble
68 R H -1.4332 Soluble
69 D H -2.6095 Soluble
70 S H -1.8722 Soluble
71 V H 0.0000 Buried
72 K H -2.6308 Soluble
74 G H -1.7756 Soluble
75 R H -1.5061 Soluble
76 F H 0.0000 Buried
77 T H -0.7882 Soluble
78 I H 0.0000 Buried
79 S H -0.8867 Soluble
80 R H -1.4567 Soluble
81 D H -1.6743 Soluble
82 N H -1.9265 Soluble
83 A H -1.2884 Soluble
84 K H -2.1050 Soluble
85 S H -1.3419 Soluble
86 S H 0.0000 Buried
87 L H 0.0000 Buried
88 Y H -0.6366 Soluble
89 L H 0.0000 Buried
90 Q H -1.3018 Soluble
91 M H 0.0000 Buried
92 N H -1.4542 Soluble
93 S H -1.3418 Soluble
94 L H 0.0000 Buried
95 R H -2.8320 Soluble
96 A H -1.9998 Soluble
97 E H -2.3552 Soluble
98 D H 0.0000 Buried
99 T H -0.7108 Soluble
100 A H 0.0000 Buried
101 V H 0.2325 Aggregation-prone
102 Y H 0.0000 Buried
103 Y H 0.0000 Buried
104 C H 0.0000 Buried
105 T H 0.0000 Buried
106 T H 0.0000 Buried
107 G H 0.0000 Buried
108 I H 2.4699 Aggregation-prone
109 V H 2.3481 Aggregation-prone
113 R H 0.7992 Aggregation-prone
114 P H 0.9853 Aggregation-prone
115 F H 0.0000 Buried
116 L H 0.2476 Aggregation-prone
117 Y H 0.2552 Aggregation-prone
118 W H 0.0000 Buried
119 G H 0.0000 Buried
120 Q H -0.8468 Soluble
121 G H -0.3333 Soluble
122 T H 0.2220 Aggregation-prone
123 L H 0.5795 Aggregation-prone
124 V H 0.0000 Buried
125 T H -0.2960 Soluble
126 V H 0.0000 Buried
127 S H -1.0032 Soluble
128 S H -0.8720 Soluble
129 A H -0.4851 Soluble
130 S H -0.5689 Soluble
131 T H -0.9330 Soluble
132 K H -1.1720 Soluble
133 G H -1.4074 Soluble
134 P H 0.0000 Buried
135 S H -0.3368 Soluble
136 V H 0.0000 Buried
137 F H 0.0000 Buried
138 P H -1.1081 Soluble
139 L H 0.0000 Buried
140 A H -1.2242 Soluble
141 P H 0.0000 Buried
142 S H -0.9063 Soluble
143 S H -1.4084 Soluble
144 K H -1.7474 Soluble
145 S H -1.1567 Soluble
146 T H -1.0086 Soluble
147 S H -0.9573 Soluble
148 G H -0.9390 Soluble
149 G H -0.8871 Soluble
150 T H -0.5931 Soluble
151 A H 0.0000 Buried
152 A H 0.0000 Buried
153 L H 0.0000 Buried
154 G H 0.0000 Buried
155 C H 0.0000 Buried
156 L H 0.0000 Buried
157 V H 0.0000 Buried
158 K H -0.3529 Soluble
159 D H -0.5066 Soluble
160 Y H 0.0000 Buried
161 F H 0.0000 Buried
162 P H 0.0000 Buried
163 E H -0.7857 Soluble
164 P H -0.8763 Soluble
165 V H -0.4925 Soluble
166 T H -0.3224 Soluble
167 V H -0.1014 Soluble
168 S H -0.3631 Soluble
169 W H 0.0000 Buried
170 N H -0.7140 Soluble
171 S H -0.6724 Soluble
172 G H -0.5844 Soluble
173 A H -0.2663 Soluble
174 L H -0.0311 Soluble
175 T H -0.1821 Soluble
176 S H -0.2453 Soluble
177 G H -0.3587 Soluble
178 V H 0.0808 Aggregation-prone
179 H H -0.2054 Soluble
180 T H -0.0245 Soluble
181 F H 0.0000 Buried
182 P H -0.1948 Soluble
183 A H 0.3453 Aggregation-prone
184 V H 0.8291 Aggregation-prone
185 L H 1.4113 Aggregation-prone
186 Q H 0.2131 Aggregation-prone
187 S H -0.0453 Soluble
188 S H -0.2671 Soluble
189 G H -0.0825 Soluble
190 L H 0.1726 Aggregation-prone
191 Y H 0.4616 Aggregation-prone
192 S H 0.0000 Buried
193 L H 0.0000 Buried
194 S H 0.0000 Buried
195 S H 0.0000 Buried
196 V H 0.0000 Buried
197 V H 0.0000 Buried
198 T H -0.1613 Soluble
199 V H 0.0000 Buried
200 P H -0.6372 Soluble
201 S H -0.5974 Soluble
202 S H -0.6954 Soluble
203 S H -0.5683 Soluble
204 L H -0.5432 Soluble
205 G H -0.9582 Soluble
206 T H -0.7010 Soluble
207 Q H -1.1010 Soluble
208 T H -1.0497 Soluble
209 Y H 0.0000 Buried
210 I H -1.0736 Soluble
211 C H 0.0000 Buried
212 N H -1.4035 Soluble
213 V H 0.0000 Buried
214 N H -1.7295 Soluble
215 H H 0.0000 Buried
216 K H -2.7563 Soluble
217 P H -1.6158 Soluble
218 S H -1.8494 Soluble
219 N H -2.5988 Soluble
220 T H -2.0586 Soluble
221 K H -2.6871 Soluble
222 V H -1.6371 Soluble
223 D H -2.5608 Soluble
224 K H -2.2340 Soluble
225 K H -2.4284 Soluble
226 V H 0.0000 Buried
227 E H -2.7544 Soluble
228 P H -2.0239 Soluble
229 K H -2.7362 Soluble
1 D L -2.1378 Soluble
2 I L -1.5642 Soluble
3 Q L -2.1389 Soluble
4 M L 0.0000 Buried
5 T L -1.2395 Soluble
6 Q L 0.0000 Buried
7 S L -0.7011 Soluble
8 P L -0.6723 Soluble
9 S L -0.9647 Soluble
10 S L -0.9740 Soluble
11 L L -0.6452 Soluble
12 S L -0.7850 Soluble
13 A L -0.9608 Soluble
14 S L -0.9708 Soluble
15 V L -0.3653 Soluble
16 G L -0.9650 Soluble
17 D L -1.8716 Soluble
18 R L -2.4337 Soluble
19 V L 0.0000 Buried
20 T L -0.6401 Soluble
21 I L 0.0000 Buried
22 T L -0.9768 Soluble
23 C L 0.0000 Buried
24 K L -2.8378 Soluble
25 S L 0.0000 Buried
26 S L -1.9877 Soluble
27 Q L -1.9814 Soluble
28 S L -0.9173 Soluble
29 L L 0.0000 Buried
30 V L 0.9270 Aggregation-prone
31 G L -0.0575 Soluble
32 A L -0.2724 Soluble
34 S L -0.5633 Soluble
35 G L -0.6220 Soluble
36 K L -0.6338 Soluble
37 T L 0.2442 Aggregation-prone
38 Y L 0.4601 Aggregation-prone
39 L L 0.0000 Buried
40 Y L 0.0000 Buried
41 W L 0.0000 Buried
42 L L 0.0000 Buried
43 F L -0.4793 Soluble
44 Q L 0.0000 Buried
45 K L -1.5553 Soluble
46 P L -1.4581 Soluble
47 G L -1.8167 Soluble
48 K L -2.4380 Soluble
49 A L -1.5596 Soluble
50 P L 0.0000 Buried
51 K L -1.0979 Soluble
52 R L 0.0000 Buried
53 L L 0.0000 Buried
54 I L 0.0000 Buried
55 Y L 0.6512 Aggregation-prone
56 L L 0.5664 Aggregation-prone
57 V L 0.2706 Aggregation-prone
65 S L 0.0413 Aggregation-prone
66 T L 0.3047 Aggregation-prone
67 L L 0.2933 Aggregation-prone
68 D L 0.0000 Buried
69 S L -0.3156 Soluble
70 G L -0.4528 Soluble
71 I L -0.1251 Soluble
72 P L -0.3108 Soluble
74 S L -0.4212 Soluble
75 R L -0.7098 Soluble
76 F L 0.0000 Buried
77 S L -0.3154 Soluble
78 G L -0.1723 Soluble
79 S L -0.6361 Soluble
80 G L -1.0526 Soluble
83 S L -0.7092 Soluble
84 G L -0.9662 Soluble
85 T L -1.8105 Soluble
86 E L -2.7947 Soluble
87 F L 0.0000 Buried
88 T L -0.8540 Soluble
89 L L 0.0000 Buried
90 T L -0.6104 Soluble
91 I L 0.0000 Buried
92 S L -1.2818 Soluble
93 S L -1.2414 Soluble
94 L L 0.0000 Buried
95 Q L -1.1879 Soluble
96 P L -1.5434 Soluble
97 E L -2.1663 Soluble
98 D L 0.0000 Buried
99 F L -1.0355 Soluble
100 A L 0.0000 Buried
101 T L 0.0000 Buried
102 Y L 0.0000 Buried
103 Y L 0.0000 Buried
104 C L 0.0000 Buried
105 L L 0.0000 Buried
106 Q L 0.0000 Buried
107 G L 0.1270 Aggregation-prone
108 T L -0.2432 Soluble
109 H L -0.9186 Soluble
114 F L -0.0561 Soluble
115 P L -0.6490 Soluble
116 H L 0.0000 Buried
117 T L -0.7335 Soluble
118 F L 0.0000 Buried
119 G L 0.0000 Buried
120 Q L -1.6918 Soluble
121 G L 0.0000 Buried
122 T L 0.0000 Buried
123 K L -1.9765 Soluble
124 L L 0.0000 Buried
125 E L -1.6561 Soluble
126 I L 0.0000 Buried
127 K L -1.5672 Soluble
128 R L -1.1149 Soluble
129 T L -0.2654 Soluble
130 V L 0.2808 Aggregation-prone
131 A L 0.0110 Aggregation-prone
132 A L -0.1685 Soluble
133 P L 0.0000 Buried
134 S L -0.1766 Soluble
135 V L 0.0000 Buried
136 F L -0.0850 Soluble
137 I L 0.0000 Buried
138 F L 0.0000 Buried
139 P L -0.8170 Soluble
140 P L 0.0000 Buried
141 S L -1.7384 Soluble
142 D L -2.9681 Soluble
143 E L -2.6814 Soluble
144 Q L 0.0000 Buried
145 L L -1.7686 Soluble
146 K L -2.6052 Soluble
147 S L -1.6402 Soluble
148 G L -1.1229 Soluble
149 T L -0.9133 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 -0.8756 Soluble
159 F L 0.0000 Buried
160 Y L 0.0000 Buried
161 P L -1.8520 Soluble
162 R L -2.9619 Soluble
163 E L -3.1885 Soluble
164 A L -2.2987 Soluble
165 K L -2.3463 Soluble
166 V L -1.2256 Soluble
167 Q L -0.8920 Soluble
168 W L 0.0000 Buried
169 K L -0.8232 Soluble
170 V L 0.0000 Buried
171 D L -2.2364 Soluble
172 N L -1.5090 Soluble
173 A L -0.4897 Soluble
174 L L 0.4528 Aggregation-prone
175 Q L -0.5626 Soluble
176 S L -0.6819 Soluble
177 G L -1.3682 Soluble
178 N L -1.6729 Soluble
179 S L -1.6450 Soluble
180 Q L -1.7778 Soluble
181 E L -1.3876 Soluble
182 S L 0.0000 Buried
183 V L -0.6133 Soluble
184 T L -1.1591 Soluble
185 E L -2.2439 Soluble
186 Q L 0.0000 Buried
187 D L -1.9381 Soluble
188 S L -2.0545 Soluble
189 K L -2.5403 Soluble
190 D L -1.9488 Soluble
191 S L -1.9272 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 -0.8014 Soluble
199 L L 0.0000 Buried
200 T L -0.4694 Soluble
201 L L -0.4293 Soluble
202 S L -0.8775 Soluble
203 K L -1.8352 Soluble
204 A L -1.7102 Soluble
205 D L -2.4071 Soluble
206 Y L 0.0000 Buried
207 E L -3.6997 Soluble
208 K L -3.7132 Soluble
209 H L -3.1242 Soluble
210 K L -3.1043 Soluble
211 V L -1.4400 Soluble
212 Y L 0.0000 Buried
213 A L 0.0000 Buried
214 C L 0.0000 Buried
215 E L -1.1370 Soluble
216 V L 0.0000 Buried
217 T L -1.2076 Soluble
218 H L 0.0000 Buried
219 Q L -1.7820 Soluble
220 G L -0.4952 Soluble
221 L L -0.2944 Soluble
222 S L -0.4866 Soluble
223 S L -0.3689 Soluble
224 P L -0.5369 Soluble
225 V L -0.0536 Soluble
226 T L -0.6829 Soluble
227 K L -0.9764 Soluble
228 S L -0.6974 Soluble
229 F L -1.1390 Soluble
230 N L -1.9341 Soluble
231 R L -2.7271 Soluble
232 G L -2.3203 Soluble
233 E L -2.2320 Soluble
234 C L -1.0979 Soluble

3D Structure — colored by A4D score

Sequence - click residue to focus in viewer  |  colored by A4D score
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Downloads
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 -0.7279 3.0002 CSV PDB
4.5 -0.771 2.9847 CSV PDB
5.0 -0.8214 2.9676 CSV PDB
5.5 -0.8688 2.9499 CSV PDB
6.0 -0.9009 2.9321 CSV PDB
6.5 -0.9084 2.9142 CSV PDB
7.0 -0.892 2.8965 CSV PDB
7.5 -0.8601 2.879 CSV PDB
8.0 -0.82 2.8627 CSV PDB
8.5 -0.7737 2.8488 CSV PDB
9.0 -0.7208 2.8395 CSV PDB
Average A4D Score vs pH
Max A4D Score vs pH