Duligotuzumab / 3p0y

A4DAB092_3p0y_H_L | Source PDB: 3p0y | Chains: H, L | Done
98.68
Yes
10 Å
Yes
Avg A4D Score
-0.7108
Max Score
2.3152
Min Score
-3.5531
Total Score
-306.37
Score CDR
-0.3667
Score non-CDR
-0.754

Calculation Parameters

Chain Sequence(s) EVQLVESGGGLVQPGGSLRLSCAASGFTLSGDWIHWVRQAPGKGLEWLGEISAAGGYTDYADSVKGRFTISADTSKNTAYLQMNSLRAEDTAVYYCARESRVSFEAAMDYWGQGTLVTVSSASTKGPSVFPLAPSSGTAALGCLVKDYFPEPVTVSWNSGALTSGVHTFPAVLQSSGLYSLSSVVTVPSSSLGTQTYICNVNHKPSNTKVDKKVEPKSDIQMTQSPSSLSASVGDRVTITCRASQDLATDVAWYQQKPGKAPKLLIYSASFLYSGVPSRFSGSGSGTDFTLTISSLQPEDFATYYCQQSEPEPYTFGQGTKVEIKRTVAAPSVFIFPPSDEQLKSGTASVVCLLNNFYPREAKVQWKVDNALQSGNSQESVTEQDSKDSTYSLSSTLTLSKADYEKHKVYACEVTHQGLSSPVTKSFNRGE 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 -3.5531
Maximum Score 2.3152
Average Score -0.7108
Total Score -306.3721

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

Index Residue Chain A4D Score Classification
1 E H -2.1152 Soluble
2 V H -1.2431 Soluble
3 Q H -1.2338 Soluble
4 L H 0.0000 Buried
5 V H 0.3912 Aggregation-prone
6 E H 0.0000 Buried
7 S H -0.6635 Soluble
8 G H -1.0088 Soluble
9 G H -0.7103 Soluble
11 G H -0.5876 Soluble
12 L H -0.1685 Soluble
13 V H 0.0000 Buried
14 Q H -1.4371 Soluble
15 P H -1.7895 Soluble
16 G H -1.5321 Soluble
17 G H -1.1481 Soluble
18 S H -1.2830 Soluble
19 L H -1.0084 Soluble
20 R H -2.0871 Soluble
21 L H 0.0000 Buried
22 S H -0.5388 Soluble
23 C H 0.0000 Buried
24 A H -0.2803 Soluble
25 A H 0.0000 Buried
26 S H -0.8636 Soluble
27 G H -1.2247 Soluble
28 F H -0.5929 Soluble
29 T H -0.5099 Soluble
30 L H 0.0000 Buried
35 S H -0.5647 Soluble
36 G H -0.5568 Soluble
37 D H -0.5764 Soluble
38 W H 0.0032 Aggregation-prone
39 I 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 -0.5649 Soluble
44 Q H -0.8813 Soluble
45 A H -1.2095 Soluble
46 P H -0.9938 Soluble
47 G H -1.4792 Soluble
48 K H -2.3992 Soluble
49 G H -1.6917 Soluble
50 L H 0.0000 Buried
51 E H -1.1077 Soluble
52 W H 0.0000 Buried
53 L H 0.0000 Buried
54 G H 0.0000 Buried
55 E H 0.0000 Buried
56 I H 0.0000 Buried
57 S H 0.0398 Aggregation-prone
58 A H -0.2986 Soluble
59 A H -0.3229 Soluble
62 G H -0.3355 Soluble
63 G H -0.1190 Soluble
64 Y H 0.8276 Aggregation-prone
65 T H 0.1370 Aggregation-prone
66 D H -1.0145 Soluble
67 Y H -1.4325 Soluble
68 A H 0.0000 Buried
69 D H -2.7529 Soluble
70 S H -1.6424 Soluble
71 V H 0.0000 Buried
72 K H -2.6270 Soluble
74 G H -1.7035 Soluble
75 R H -1.2525 Soluble
76 F H 0.0000 Buried
77 T H -0.9944 Soluble
78 I H 0.0000 Buried
79 S H -0.3184 Soluble
80 A H -0.8090 Soluble
81 D H -1.3994 Soluble
82 T H -1.1507 Soluble
83 S H -1.3449 Soluble
84 K H -2.1247 Soluble
85 N H -1.3352 Soluble
86 T H 0.0000 Buried
87 A H 0.0000 Buried
88 Y H 0.0000 Buried
89 L H 0.0000 Buried
90 Q H -1.2918 Soluble
91 M H 0.0000 Buried
92 N H -1.4483 Soluble
93 S H -1.3287 Soluble
94 L H 0.0000 Buried
95 R H -2.9087 Soluble
96 A H -1.9939 Soluble
97 E H -2.4286 Soluble
98 D H 0.0000 Buried
99 T H -0.8963 Soluble
100 A H 0.0000 Buried
101 V H 0.0963 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 -0.4010 Soluble
107 E H -0.2607 Soluble
108 S H 0.0000 Buried
109 R H -1.0087 Soluble
110 V H 0.6701 Aggregation-prone
111 S H 0.7877 Aggregation-prone
112A F H 1.5121 Aggregation-prone
112 E H 0.0000 Buried
113 A H 0.0000 Buried
114 A H 0.0000 Buried
115 M H 0.0000 Buried
116 D H -0.3425 Soluble
117 Y H -0.1294 Soluble
118 W H -0.4488 Soluble
119 G H 0.0000 Buried
120 Q H -1.4442 Soluble
121 G H -0.6794 Soluble
122 T H -0.1290 Soluble
123 L H -0.2270 Soluble
124 V H 0.0000 Buried
125 T H 0.0000 Buried
126 V H 0.0000 Buried
127 S H -1.0316 Soluble
128 S H -0.7908 Soluble
129 A H -0.4594 Soluble
130 S H -0.5772 Soluble
131 T H -0.6705 Soluble
132 K H -1.1319 Soluble
133 G H -1.4255 Soluble
134 P H -0.6822 Soluble
135 S H -0.2650 Soluble
136 V H 0.0000 Buried
137 F H 0.0000 Buried
138 P H -1.2738 Soluble
139 L H 0.0000 Buried
140 A H -1.2758 Soluble
141 P H 0.0000 Buried
142 S H -0.7772 Soluble
143 S H -0.5371 Soluble
144 G H -0.6393 Soluble
145 T H -0.4974 Soluble
146 A H 0.0000 Buried
147 A H 0.0000 Buried
148 L H 0.0000 Buried
149 G H 0.0000 Buried
150 C H 0.0000 Buried
151 L H 0.0000 Buried
152 V H 0.0000 Buried
153 K H 0.0000 Buried
154 D H -0.4273 Soluble
155 Y H 0.0000 Buried
156 F H 0.0000 Buried
157 P H 0.0000 Buried
158 E H -0.5772 Soluble
159 P H -0.8606 Soluble
160 V H -0.9575 Soluble
161 T H -0.8359 Soluble
162 V H -0.5517 Soluble
163 S H -0.4753 Soluble
164 W H 0.0000 Buried
165 N H -0.7111 Soluble
166 S H -0.6311 Soluble
167 G H -0.5572 Soluble
168 A H -0.2470 Soluble
169 L H -0.0318 Soluble
170 T H -0.2025 Soluble
171 S H -0.2179 Soluble
172 G H -0.2779 Soluble
173 V H 0.1384 Aggregation-prone
174 H H -0.2951 Soluble
175 T H 0.0060 Aggregation-prone
176 F H 0.0000 Buried
177 P H -0.3267 Soluble
178 A H 0.1368 Aggregation-prone
179 V H 0.3694 Aggregation-prone
180 L H 0.8746 Aggregation-prone
181 Q H 0.0427 Aggregation-prone
182 S H -0.3014 Soluble
183 S H -0.2746 Soluble
184 G H -0.0530 Soluble
185 L H 0.0092 Aggregation-prone
186 Y H 0.3041 Aggregation-prone
187 S H 0.0000 Buried
188 L H 0.0000 Buried
189 S H 0.0000 Buried
190 S H 0.0000 Buried
191 V H 0.0000 Buried
192 V H 0.0000 Buried
193 T H -0.1509 Soluble
194 V H 0.0000 Buried
195 P H -0.5800 Soluble
196 S H -0.5480 Soluble
197 S H -0.6024 Soluble
198 S H -0.5726 Soluble
199 L H -0.8463 Soluble
200 G H -0.9530 Soluble
201 T H -0.6634 Soluble
202 Q H -1.0832 Soluble
203 T H -1.0522 Soluble
204 Y H 0.0000 Buried
205 I H -1.2005 Soluble
206 C H 0.0000 Buried
207 N H -1.6066 Soluble
208 V H 0.0000 Buried
209 N H -2.5640 Soluble
210 H H 0.0000 Buried
211 K H -2.9774 Soluble
212 P H -1.6705 Soluble
213 S H -1.9083 Soluble
214 N H -2.5961 Soluble
215 T H -2.2474 Soluble
216 K H -2.8844 Soluble
217 V H -1.5273 Soluble
218 D H -2.5004 Soluble
219 K H -2.0230 Soluble
220 K H -2.5618 Soluble
221 V H 0.0000 Buried
222 E H -2.8936 Soluble
223 P H -2.0069 Soluble
224 K H -2.5827 Soluble
225 S H -1.3028 Soluble
1 D L -2.3685 Soluble
2 I L -1.6621 Soluble
3 Q L -1.9091 Soluble
4 M L 0.0000 Buried
5 T L -1.3765 Soluble
6 Q L 0.0000 Buried
7 S L -0.8464 Soluble
8 P L -0.4931 Soluble
9 S L -0.8193 Soluble
10 S L -0.8334 Soluble
11 L L -0.5657 Soluble
12 S L -0.8388 Soluble
13 A L -0.9761 Soluble
14 S L -0.9308 Soluble
15 V L -0.2501 Soluble
16 G L -0.9657 Soluble
17 D L -1.9257 Soluble
18 R L -2.3740 Soluble
19 V L 0.0000 Buried
20 T L -0.6355 Soluble
21 I L 0.0000 Buried
22 T L -0.8415 Soluble
23 C L 0.0000 Buried
24 R L -2.8941 Soluble
25 A L 0.0000 Buried
26 S L -2.1282 Soluble
27 Q L -2.7813 Soluble
28 D L -2.7937 Soluble
29 L L 0.0000 Buried
36 A L -1.0957 Soluble
37 T L -0.7610 Soluble
38 D L -0.5475 Soluble
39 V 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 -1.8754 Soluble
46 P L -1.4592 Soluble
47 G L -1.7738 Soluble
48 K L -2.5984 Soluble
49 A L -1.5722 Soluble
50 P L 0.0000 Buried
51 K L -1.3596 Soluble
52 L L 0.0000 Buried
53 L L 0.0000 Buried
54 I L 0.0000 Buried
55 Y L 1.0626 Aggregation-prone
56 S L 0.0000 Buried
57 A L 0.0000 Buried
65 S L 0.7916 Aggregation-prone
66 F L 2.3152 Aggregation-prone
67 L L 1.5014 Aggregation-prone
68 Y L 0.7735 Aggregation-prone
69 S L 0.1326 Aggregation-prone
70 G L -0.4743 Soluble
71 V L 0.0000 Buried
72 P L -0.3566 Soluble
74 S L -0.3980 Soluble
75 R L -0.8004 Soluble
76 F L 0.0000 Buried
77 S L 0.0642 Aggregation-prone
78 G L 0.1793 Aggregation-prone
79 S L -0.3884 Soluble
80 G L -1.0003 Soluble
83 S L -1.0274 Soluble
84 G L -1.7734 Soluble
85 T L -2.2514 Soluble
86 D L -2.3881 Soluble
87 F L 0.0000 Buried
88 T L -0.7641 Soluble
89 L L 0.0000 Buried
90 T L -0.6059 Soluble
91 I L 0.0000 Buried
92 S L -1.2918 Soluble
93 S L -1.2372 Soluble
94 L L 0.0000 Buried
95 Q L -0.9807 Soluble
96 P L -1.7146 Soluble
97 E L -2.1237 Soluble
98 D L 0.0000 Buried
99 F L 0.0000 Buried
100 A L 0.0000 Buried
101 T L -0.9358 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 S L 0.0000 Buried
108 E L -1.2184 Soluble
109 P L -1.1669 Soluble
114 E L -1.9243 Soluble
115 P L -1.7340 Soluble
116 Y L 0.0000 Buried
117 T L -1.1066 Soluble
118 F L 0.0000 Buried
119 G L 0.0000 Buried
120 Q L -1.8274 Soluble
121 G L 0.0000 Buried
122 T L 0.0000 Buried
123 K L -1.5954 Soluble
124 V L 0.0000 Buried
125 E L -1.3513 Soluble
126 I L 0.0000 Buried
127 K L -1.1602 Soluble
128 R L -0.9244 Soluble
129 T L -0.1633 Soluble
130 V L 0.1953 Aggregation-prone
131 A L 0.0093 Aggregation-prone
132 A L -0.1607 Soluble
133 P L 0.0000 Buried
134 S L -0.0793 Soluble
135 V L 0.0697 Aggregation-prone
136 F L 0.1363 Aggregation-prone
137 I L 0.0000 Buried
138 F L 0.0000 Buried
139 P L -0.5516 Soluble
140 P L 0.0000 Buried
141 S L -1.7194 Soluble
142 D L -2.9538 Soluble
143 E L -2.5889 Soluble
144 Q L 0.0000 Buried
145 L L -2.1791 Soluble
146 K L -2.7202 Soluble
147 S L -1.7121 Soluble
148 G L -1.3699 Soluble
149 T L -1.0139 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 -1.0068 Soluble
159 F L 0.0000 Buried
160 Y L 0.0000 Buried
161 P L -1.6158 Soluble
162 R L -2.6938 Soluble
163 E L -3.0439 Soluble
164 A L -2.2828 Soluble
165 K L -2.3999 Soluble
166 V L -1.3185 Soluble
167 Q L -0.6997 Soluble
168 W L 0.0000 Buried
169 K L -0.7463 Soluble
170 V L 0.0000 Buried
171 D L -2.0173 Soluble
172 N L -1.6505 Soluble
173 A L -0.3782 Soluble
174 L L 0.5041 Aggregation-prone
175 Q L -0.3751 Soluble
176 S L -0.6616 Soluble
177 G L -1.2023 Soluble
178 N L -1.4872 Soluble
179 S L -1.4454 Soluble
180 Q L -1.5602 Soluble
181 E L -1.9667 Soluble
182 S L -1.0032 Soluble
183 V L -0.7548 Soluble
184 T L -0.9116 Soluble
185 E L -1.6925 Soluble
186 Q L 0.0000 Buried
187 D L -2.1842 Soluble
188 S L -2.3566 Soluble
189 K L -2.8093 Soluble
190 D L -2.2868 Soluble
191 S L 0.0000 Buried
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 -0.7834 Soluble
199 L L 0.0000 Buried
200 T L -0.6571 Soluble
201 L L -0.8457 Soluble
202 S L -1.1054 Soluble
203 K L -2.0561 Soluble
204 A L -1.9032 Soluble
205 D L -2.7172 Soluble
206 Y L 0.0000 Buried
207 E L -3.2379 Soluble
208 K L -3.5531 Soluble
209 H L -3.1337 Soluble
210 K L -3.2481 Soluble
211 V L -1.4517 Soluble
212 Y L 0.0000 Buried
213 A L 0.0000 Buried
214 C L 0.0000 Buried
215 E L -0.9241 Soluble
216 V L 0.0000 Buried
217 T L -1.2433 Soluble
218 H L 0.0000 Buried
219 Q L -1.7101 Soluble
220 G L -0.4721 Soluble
221 L L -0.2589 Soluble
222 S L -0.4664 Soluble
223 S L -0.4420 Soluble
224 P L -0.5825 Soluble
225 V L -0.0247 Soluble
226 T L -0.4547 Soluble
227 K L -0.6117 Soluble
228 S L -0.5731 Soluble
229 F L -0.9585 Soluble
230 N L -1.9620 Soluble
231 R L -2.5201 Soluble
232 G L -2.1445 Soluble
233 E L -2.5258 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
Load structure at specific pH condition
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 -0.7196 4.0236 CSV PDB
4.5 -0.7661 4.0236 CSV PDB
5.0 -0.8204 4.0236 CSV PDB
5.5 -0.8728 4.0236 CSV PDB
6.0 -0.9119 4.0236 CSV PDB
6.5 -0.9283 4.0236 CSV PDB
7.0 -0.921 4.0236 CSV PDB
7.5 -0.8979 4.0235 CSV PDB
8.0 -0.8657 4.0235 CSV PDB
8.5 -0.8264 4.0234 CSV PDB
9.0 -0.7799 4.0231 CSV PDB
Average A4D Score vs pH
Max A4D Score vs pH