Tomuzotuximab / 6au5

A4DAB272_6au5_B_A | Source PDB: 6au5 | Chains: B, A | Done
99.56
Yes
10 Å
Yes
Avg A4D Score
-0.6773
Max Score
2.2417
Min Score
-3.571
Total Score
-292.6
Score CDR
-0.2764
Score non-CDR
-0.7251

Calculation Parameters

Chain Sequence(s) QVQLKQSGPGLVQPSQSLSITCTVSGFSLTNYGVHWVRQSPGKGLEWLGVIWSGGNTDYNTPFTSRLSINKDNSKSQVFFKMNSLQSNDTAIYYCARALTYYDYEFAYWGQGTLVTVSAASTKGPSVFPLAPSSKSTSGGTAALGCLVKDYFPEPVTVSWNSGALTSGVHTFPAVLQSSGLYSLSSVVTVPSSSLGTQTYICNVNHKPSNTKVDKRVEPKDILLTQSPVILSVSPGERVSFSCRASQSIGTNIHWYQQRTNGSPRLLIKYASESISGIPSRFSGSGSGTDFTLSINSVESEDIADYYCQQNNNWPTTFGAGTKLELKRTVAAPSVFIFPPSDEQLKSGTASVVCLLNNFYPREAKVQWKVDNALQSGNSQESVTEQDSKDSTYSLSSTLTLSKADYEKHKVYACEVTHQGLSSPVTKSFNRG input.pdb
Selected Chain(s) B (Heavy), A (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 -3.571
Maximum Score 2.2417
Average Score -0.6773
Total Score -292.5991

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

Index Residue Chain A4D Score Classification
1 Q B -1.4127 Soluble
2 V B -0.7354 Soluble
3 Q B -1.5841 Soluble
4 L B 0.0000 Buried
5 K B -2.3305 Soluble
6 Q B 0.0000 Buried
7 S B -0.8411 Soluble
8 G B -1.1702 Soluble
9 P B -0.5530 Soluble
11 G B -0.4674 Soluble
12 L B 0.0642 Aggregation-prone
13 V B -0.5557 Soluble
14 Q B -1.1334 Soluble
15 P B -1.3964 Soluble
16 S B -1.6084 Soluble
17 Q B -1.9892 Soluble
18 S B -1.8470 Soluble
19 L B 0.0000 Buried
20 S B -0.8141 Soluble
21 I B 0.0000 Buried
22 T B -0.5307 Soluble
23 C B 0.0000 Buried
24 T B -1.1553 Soluble
25 V B 0.0000 Buried
26 S B -1.2266 Soluble
27 G B -0.9499 Soluble
28 F B -0.5254 Soluble
29 S B -0.8618 Soluble
30 L B 0.0000 Buried
35 T B -0.8789 Soluble
36 N B -0.8355 Soluble
37 Y B 0.4352 Aggregation-prone
38 G B 0.0000 Buried
39 V B 0.0000 Buried
40 H B 0.0000 Buried
41 W B 0.0000 Buried
42 V B 0.0000 Buried
43 R B 0.0000 Buried
44 Q B -0.4376 Soluble
45 S B -1.0127 Soluble
46 P B -1.1661 Soluble
47 G B -1.7402 Soluble
48 K B -2.2210 Soluble
49 G B -1.1188 Soluble
50 L B 0.0000 Buried
51 E B 0.0000 Buried
52 W B 0.0000 Buried
53 L B 0.0000 Buried
54 G B 0.0000 Buried
55 V B 0.0000 Buried
56 I B 0.0000 Buried
57 W B -0.5493 Soluble
58 S B -0.6544 Soluble
59 G B -1.1299 Soluble
63 G B -1.5307 Soluble
64 N B -1.8663 Soluble
65 T B -1.3398 Soluble
66 D B -1.0803 Soluble
67 Y B -0.3955 Soluble
68 N B 0.0000 Buried
69 T B -0.1968 Soluble
70 P B -0.3631 Soluble
71 F B 0.0000 Buried
72 T B -0.4637 Soluble
74 S B -0.6672 Soluble
75 R B -1.2876 Soluble
76 L B 0.0000 Buried
77 S B -1.2523 Soluble
78 I B 0.0000 Buried
79 N B -1.7582 Soluble
80 K B -1.4321 Soluble
81 D B -1.7771 Soluble
82 N B -2.1464 Soluble
83 S B -1.6795 Soluble
84 K B -2.3606 Soluble
85 S B -1.6033 Soluble
86 Q B -1.4931 Soluble
87 V B 0.0000 Buried
88 F B -0.2887 Soluble
89 F B 0.0000 Buried
90 K B -1.9248 Soluble
91 M B 0.0000 Buried
92 N B -2.3802 Soluble
93 S B -1.7166 Soluble
94 L B 0.0000 Buried
95 Q B -2.2135 Soluble
96 S B -1.5343 Soluble
97 N B -2.0862 Soluble
98 D B 0.0000 Buried
99 T B -0.6219 Soluble
100 A B 0.0000 Buried
101 I B 0.5481 Aggregation-prone
102 Y B 0.0000 Buried
103 Y B 0.0000 Buried
104 C B 0.0000 Buried
105 A B 0.0000 Buried
106 R B 0.0000 Buried
107 A B 0.0000 Buried
108 L B 1.0257 Aggregation-prone
109 T B 1.1820 Aggregation-prone
110 Y B 1.8815 Aggregation-prone
111 Y B 2.0058 Aggregation-prone
112 D B 0.0000 Buried
113 Y B 0.7704 Aggregation-prone
114 E B 0.0000 Buried
115 F B 0.0000 Buried
116 A B 0.2982 Aggregation-prone
117 Y B 0.2617 Aggregation-prone
118 W B -0.4545 Soluble
119 G B 0.0000 Buried
120 Q B -1.8090 Soluble
121 G B -0.8835 Soluble
122 T B 0.0000 Buried
123 L B 0.2421 Aggregation-prone
124 V B 0.0000 Buried
125 T B -0.2524 Soluble
126 V B 0.0000 Buried
127 S B -0.5608 Soluble
128 A B -0.2060 Soluble
129 A B -0.2597 Soluble
130 S B -0.5120 Soluble
131 T B -0.8785 Soluble
132 K B -1.5291 Soluble
133 G B -1.5967 Soluble
134 P B 0.0000 Buried
135 S B -0.5099 Soluble
136 V B 0.0000 Buried
137 F B 0.0000 Buried
138 P B -1.2652 Soluble
139 L B 0.0000 Buried
140 A B -1.2455 Soluble
141 P B 0.0000 Buried
142 S B -1.0799 Soluble
143 S B -0.7357 Soluble
144 K B -1.1142 Soluble
145 S B 0.0000 Buried
146 T B -0.7280 Soluble
147 S B -0.7335 Soluble
148 G B -0.7998 Soluble
149 G B -0.8845 Soluble
150 T B -0.6175 Soluble
151 A B 0.0000 Buried
152 A B 0.0000 Buried
153 L B 0.0000 Buried
154 G B 0.0000 Buried
155 C B 0.0000 Buried
156 L B 0.0000 Buried
157 V B 0.0000 Buried
158 K B 0.0000 Buried
159 D B -0.6363 Soluble
160 Y B 0.0000 Buried
161 F B 0.0000 Buried
162 P B 0.0000 Buried
163 E B -0.3470 Soluble
164 P B -0.5565 Soluble
165 V B -0.6115 Soluble
166 T B -0.5645 Soluble
167 V B -0.1558 Soluble
168 S B -0.3821 Soluble
169 W B 0.0000 Buried
170 N B -0.8778 Soluble
171 S B -0.6960 Soluble
172 G B -0.6198 Soluble
173 A B -0.3010 Soluble
174 L B -0.0742 Soluble
175 T B -0.2152 Soluble
176 S B -0.2061 Soluble
177 G B -0.2461 Soluble
178 V B 0.1570 Aggregation-prone
179 H B -0.2735 Soluble
180 T B -0.1475 Soluble
181 F B 0.0000 Buried
182 P B -0.2724 Soluble
183 A B 0.2756 Aggregation-prone
184 V B 0.5715 Aggregation-prone
185 L B 1.1293 Aggregation-prone
186 Q B 0.2389 Aggregation-prone
187 S B -0.0922 Soluble
188 S B -0.2772 Soluble
189 G B -0.0379 Soluble
190 L B -0.0055 Soluble
191 Y B 0.3924 Aggregation-prone
192 S B 0.0000 Buried
193 L B 0.0000 Buried
194 S B 0.0000 Buried
195 S B 0.0000 Buried
196 V B 0.0000 Buried
197 V B 0.0000 Buried
198 T B -0.1446 Soluble
199 V B 0.0000 Buried
200 P B -0.5319 Soluble
201 S B -0.5660 Soluble
202 S B -0.6217 Soluble
203 S B -0.7012 Soluble
204 L B -0.8057 Soluble
205 G B -0.9721 Soluble
206 T B -0.8542 Soluble
207 Q B -1.4301 Soluble
208 T B -1.2373 Soluble
209 Y B 0.0000 Buried
210 I B -1.1692 Soluble
211 C B 0.0000 Buried
212 N B -1.4055 Soluble
213 V B 0.0000 Buried
214 N B -1.9304 Soluble
215 H B 0.0000 Buried
216 K B -2.8296 Soluble
217 P B -1.6737 Soluble
218 S B -1.9114 Soluble
219 N B -2.5991 Soluble
220 T B -2.1016 Soluble
221 K B -2.6661 Soluble
222 V B -1.5990 Soluble
223 D B -2.2992 Soluble
224 K B -2.0133 Soluble
225 R B -2.4654 Soluble
226 V B 0.0000 Buried
227 E B -2.5269 Soluble
228 P B -1.7548 Soluble
229 K B -2.3595 Soluble
1 D A -1.3204 Soluble
2 I A 0.0000 Buried
3 L A 0.6052 Aggregation-prone
4 L A 0.0000 Buried
5 T A -0.3149 Soluble
6 Q A 0.0000 Buried
7 S A 0.2423 Aggregation-prone
8 P A 1.0891 Aggregation-prone
9 V A 2.2417 Aggregation-prone
10 I A 2.0878 Aggregation-prone
11 L A 1.0505 Aggregation-prone
12 S A -0.0182 Soluble
13 V A -1.0279 Soluble
14 S A -1.7707 Soluble
15 P A -2.0673 Soluble
16 G A -2.3550 Soluble
17 E A -3.1013 Soluble
18 R A -3.4423 Soluble
19 V A 0.0000 Buried
20 S A -0.6590 Soluble
21 F A 0.0000 Buried
22 S A -0.6557 Soluble
23 C A 0.0000 Buried
24 R A -2.3572 Soluble
25 A A -1.2151 Soluble
26 S A -0.9338 Soluble
27 Q A -1.2775 Soluble
28 S A -1.4237 Soluble
29 I A 0.0000 Buried
36 G A -0.8963 Soluble
37 T A -0.6961 Soluble
38 N A -0.7414 Soluble
39 I A 0.0000 Buried
40 H A 0.0000 Buried
41 W A 0.0000 Buried
42 Y A 0.0000 Buried
43 Q A 0.0000 Buried
44 Q A -1.1544 Soluble
45 R A -1.7041 Soluble
46 T A -1.5616 Soluble
47 N A -1.9031 Soluble
48 G A -1.4486 Soluble
49 S A -0.9219 Soluble
50 P A 0.0000 Buried
51 R A -0.6791 Soluble
52 L A 0.0000 Buried
53 L A 0.0000 Buried
54 I A 0.0000 Buried
55 K A -0.7299 Soluble
56 Y A -0.5822 Soluble
57 A A 0.0000 Buried
65 S A -1.2926 Soluble
66 E A -2.0082 Soluble
67 S A -1.1951 Soluble
68 I A -0.5672 Soluble
69 S A -0.3377 Soluble
70 G A -0.4749 Soluble
71 I A -0.2542 Soluble
72 P A -0.3113 Soluble
74 S A -0.6036 Soluble
75 R A -1.2347 Soluble
76 F A 0.0000 Buried
77 S A -0.9483 Soluble
78 G A -0.7262 Soluble
79 S A -0.8307 Soluble
80 G A -1.0070 Soluble
83 S A -1.0547 Soluble
84 G A -1.2305 Soluble
85 T A -1.7543 Soluble
86 D A -2.2276 Soluble
87 F A 0.0000 Buried
88 T A -0.7619 Soluble
89 L A 0.0000 Buried
90 S A -0.9299 Soluble
91 I A 0.0000 Buried
92 N A -2.8578 Soluble
93 S A -2.5864 Soluble
94 V A 0.0000 Buried
95 E A -2.9915 Soluble
96 S A -2.4291 Soluble
97 E A -2.2748 Soluble
98 D A 0.0000 Buried
99 I A 0.0000 Buried
100 A A 0.0000 Buried
101 D A -0.4988 Soluble
102 Y A 0.0000 Buried
103 Y A 0.0000 Buried
104 C A 0.0000 Buried
105 Q A 0.0000 Buried
106 Q A 0.0000 Buried
107 N A -0.5202 Soluble
108 N A -1.1162 Soluble
109 N A -0.8906 Soluble
114 W A 0.1641 Aggregation-prone
115 P A -0.1701 Soluble
116 T A 0.0000 Buried
117 T A -0.0114 Soluble
118 F A 0.2007 Aggregation-prone
119 G A 0.0000 Buried
120 A A 0.1006 Aggregation-prone
121 G A 0.0000 Buried
122 T A 0.0000 Buried
123 K A 0.3914 Aggregation-prone
124 L A 0.0000 Buried
125 E A -0.4519 Soluble
126 L A 0.0000 Buried
127 K A -1.5141 Soluble
128 R A -1.1593 Soluble
129 T A -0.1036 Soluble
130 V A 0.4280 Aggregation-prone
131 A A 0.2011 Aggregation-prone
132 A A -0.0643 Soluble
133 P A 0.0000 Buried
134 S A -0.1862 Soluble
135 V A 0.0000 Buried
136 F A 0.0000 Buried
137 I A 0.0000 Buried
138 F A 0.0000 Buried
139 P A -0.7334 Soluble
140 P A -0.8419 Soluble
141 S A -1.8728 Soluble
142 D A -3.1321 Soluble
143 E A -3.0255 Soluble
144 Q A 0.0000 Buried
145 L A -2.2478 Soluble
146 K A -2.7945 Soluble
147 S A -1.7189 Soluble
148 G A -1.2139 Soluble
149 T A -0.9941 Soluble
150 A A 0.0000 Buried
151 S A 0.0000 Buried
152 V A 0.0000 Buried
153 V A 0.0000 Buried
154 C A 0.0000 Buried
155 L A 0.0000 Buried
156 L A 0.0000 Buried
157 N A 0.0000 Buried
158 N A -0.8691 Soluble
159 F A 0.0000 Buried
160 Y A -1.1279 Soluble
161 P A -1.7107 Soluble
162 R A -2.8746 Soluble
163 E A -3.2437 Soluble
164 A A -2.3303 Soluble
165 K A -2.3011 Soluble
166 V A -1.3745 Soluble
167 Q A -1.1784 Soluble
168 W A 0.0000 Buried
169 K A -0.7189 Soluble
170 V A 0.0000 Buried
171 D A -1.5619 Soluble
172 N A -1.3345 Soluble
173 A A -0.1603 Soluble
174 L A 0.6669 Aggregation-prone
175 Q A -0.2068 Soluble
176 S A -0.4759 Soluble
177 G A -0.9086 Soluble
178 N A -0.8464 Soluble
179 S A -1.0876 Soluble
180 Q A -1.2336 Soluble
181 E A -1.5756 Soluble
182 S A -0.8132 Soluble
183 V A -0.7171 Soluble
184 T A -0.9803 Soluble
185 E A -1.9802 Soluble
186 Q A 0.0000 Buried
187 D A -1.8231 Soluble
188 S A -2.2356 Soluble
189 K A -2.6556 Soluble
190 D A -1.8580 Soluble
191 S A 0.0000 Buried
192 T A 0.0000 Buried
193 Y A 0.0000 Buried
194 S A 0.0000 Buried
195 L A 0.0000 Buried
196 S A 0.0000 Buried
197 S A 0.0000 Buried
198 T A -0.5953 Soluble
199 L A 0.0000 Buried
200 T A -0.2989 Soluble
201 L A -0.6736 Soluble
202 S A -1.0277 Soluble
203 K A -1.9481 Soluble
204 A A -1.8961 Soluble
205 D A -2.6458 Soluble
206 Y A 0.0000 Buried
207 E A -3.3520 Soluble
208 K A -3.5710 Soluble
209 H A -2.9579 Soluble
210 K A -3.0966 Soluble
211 V A -1.3166 Soluble
212 Y A 0.0000 Buried
213 A A 0.0000 Buried
214 C A 0.0000 Buried
215 E A -1.3281 Soluble
216 V A 0.0000 Buried
217 T A -1.4160 Soluble
218 H A 0.0000 Buried
219 Q A -1.5276 Soluble
220 G A -0.3661 Soluble
221 L A -0.1842 Soluble
222 S A -0.4367 Soluble
223 S A -0.4328 Soluble
224 P A -0.7257 Soluble
225 V A -0.1388 Soluble
226 T A -0.5733 Soluble
227 K A -0.6761 Soluble
228 S A -0.6945 Soluble
229 F A 0.0000 Buried
230 N A -2.1490 Soluble
231 R A -2.5042 Soluble
232 G A -1.4074 Soluble

3D Structure — colored by A4D score

Sequence - click residue to focus in viewer  |  colored by A4D score
Load structure to view sequence…
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 -0.6837 2.84 CSV PDB
4.5 -0.719 2.7751 CSV PDB
5.0 -0.7609 2.696 CSV PDB
5.5 -0.8007 2.6108 CSV PDB
6.0 -0.8281 2.5575 CSV PDB
6.5 -0.8348 2.5599 CSV PDB
7.0 -0.8209 2.5797 CSV PDB
7.5 -0.7934 2.611 CSV PDB
8.0 -0.7588 2.6479 CSV PDB
8.5 -0.7192 2.6882 CSV PDB
9.0 -0.6752 2.7322 CSV PDB
Average A4D Score vs pH
Max A4D Score vs pH