Daratumumab / 7dha

A4DAB081_7dha_C_B | Source PDB: 7dha | Chains: C, B | Done
100
Yes
10 Å
Yes
Avg A4D Score
-0.6915
Max Score
2.1575
Min Score
-3.817
Total Score
-300.11
Score CDR
-0.2234
Score non-CDR
-0.7511

Calculation Parameters

Chain Sequence(s) EVQLLESGGGLVQPGGSLRLSCAVSGFTFNSFAMSWVRQAPGKGLEWVSAISGSGGGTYYADSVKGRFTISRDNSKNTLYLQMNSLRAEDTAVYFCAKDKILWFGEPVFDYWGQGTLVTVSSASTKGPSVFPLAPSSKSTSGGTAALGCLVKDYFPEPVTVSWNSGALTSGVHTFPAVLQSSGLYSLSSVVTVPSSSLGTQTYICNVNHKPSNTKVDKKVEPEIVLTQSPATLSLSPGERATLSCRASQSVSSYLAWYQQKPGQAPRLLIYDASNRATGIPARFSGSGSGTDFTLTISSLEPEDFAVYYCQQRSNWPPTFGQGTKVEIKRTVAAPSVFIFPPSDEQLKSGTASVVCLLNNFYPREAKVQWKVDNALQSGNSQESVTEQDSKDSTYSLSSTLTLSKADYEKHKVYACEVTHQGLSSPVTKSFNRG input.pdb
Selected Chain(s) C (Heavy), B (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 -3.817
Maximum Score 2.1575
Average Score -0.6915
Total Score -300.1064

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

Index Residue Chain A4D Score Classification
1 E C -2.1962 Soluble
2 V C -1.3964 Soluble
3 Q C -1.4218 Soluble
4 L C 0.0000 Buried
5 L C 0.6414 Aggregation-prone
6 E C 0.0000 Buried
7 S C -0.4694 Soluble
8 G C -0.8913 Soluble
9 G C -0.5885 Soluble
11 G C -0.3193 Soluble
12 L C -0.1301 Soluble
13 V C 0.0000 Buried
14 Q C -1.6651 Soluble
15 P C -1.8467 Soluble
16 G C -1.6079 Soluble
17 G C -1.2745 Soluble
18 S C -1.3830 Soluble
19 L C -1.2824 Soluble
20 R C -2.1523 Soluble
21 L C 0.0000 Buried
22 S C -0.4635 Soluble
23 C C 0.0000 Buried
24 A C -0.2797 Soluble
25 V C 0.0000 Buried
26 S C -0.9848 Soluble
27 G C -1.3517 Soluble
28 F C -0.6914 Soluble
29 T C -0.5501 Soluble
30 F C 0.0000 Buried
35 N C -1.6237 Soluble
36 S C -0.1106 Soluble
37 F C 0.5634 Aggregation-prone
38 A C 0.0000 Buried
39 M C 0.0000 Buried
40 S C 0.0000 Buried
41 W C 0.0000 Buried
42 V C 0.0000 Buried
43 R C 0.0000 Buried
44 Q C -0.8004 Soluble
45 A C -1.1742 Soluble
46 P C -0.9652 Soluble
47 G C -1.4625 Soluble
48 K C -2.3633 Soluble
49 G C -1.6201 Soluble
50 L C 0.0000 Buried
51 E C -1.1029 Soluble
52 W C 0.0000 Buried
53 V C 0.0000 Buried
54 S C 0.0000 Buried
55 A C 0.0000 Buried
56 I C 0.0000 Buried
57 S C 0.0000 Buried
58 G C -0.2546 Soluble
59 S C -0.8847 Soluble
62 G C -0.8420 Soluble
63 G C -0.6995 Soluble
64 G C -0.2594 Soluble
65 T C 0.1672 Aggregation-prone
66 Y C 0.2465 Aggregation-prone
67 Y C -0.5594 Soluble
68 A C 0.0000 Buried
69 D C -2.6268 Soluble
70 S C -1.7840 Soluble
71 V C 0.0000 Buried
72 K C -2.5260 Soluble
74 G C -1.8556 Soluble
75 R C -1.4684 Soluble
76 F C 0.0000 Buried
77 T C -0.9115 Soluble
78 I C 0.0000 Buried
79 S C -0.5357 Soluble
80 R C -1.2119 Soluble
81 D C -1.8025 Soluble
82 N C -1.9357 Soluble
83 S C -1.7132 Soluble
84 K C -2.3526 Soluble
85 N C -1.8998 Soluble
86 T C 0.0000 Buried
87 L C 0.0000 Buried
88 Y C -0.6403 Soluble
89 L C 0.0000 Buried
90 Q C -1.5254 Soluble
91 M C 0.0000 Buried
92 N C -2.0579 Soluble
93 S C -1.5471 Soluble
94 L C 0.0000 Buried
95 R C -2.4438 Soluble
96 A C -1.7707 Soluble
97 E C -2.2594 Soluble
98 D C 0.0000 Buried
99 T C -0.7354 Soluble
100 A C 0.0000 Buried
101 V C 0.0550 Aggregation-prone
102 Y C 0.0000 Buried
103 F C 0.0000 Buried
104 C C 0.0000 Buried
105 A C 0.0000 Buried
106 K C 0.0000 Buried
107 D C 0.0000 Buried
108 K C 0.1731 Aggregation-prone
109 I C 0.0000 Buried
110 L C 2.1575 Aggregation-prone
111 W C 2.1178 Aggregation-prone
111A F C 1.3046 Aggregation-prone
112A G C 0.3657 Aggregation-prone
112 E C -0.3746 Soluble
113 P C 0.0000 Buried
114 V C 0.0000 Buried
115 F C 0.0000 Buried
116 D C -0.4041 Soluble
117 Y C -0.0507 Soluble
118 W C -0.2994 Soluble
119 G C 0.0000 Buried
120 Q C -1.3478 Soluble
121 G C -0.5447 Soluble
122 T C -0.1289 Soluble
123 L C 0.1206 Aggregation-prone
124 V C 0.0000 Buried
125 T C -0.4740 Soluble
126 V C 0.0000 Buried
127 S C -0.7977 Soluble
128 S C -0.7017 Soluble
129 A C -0.4860 Soluble
130 S C -0.6135 Soluble
131 T C -0.7357 Soluble
132 K C -1.5687 Soluble
133 G C -1.6582 Soluble
134 P C 0.0000 Buried
135 S C -0.5222 Soluble
136 V C 0.0000 Buried
137 F C 0.0000 Buried
138 P C -1.0031 Soluble
139 L C 0.0000 Buried
140 A C -0.7705 Soluble
141 P C 0.0000 Buried
142 S C -0.7498 Soluble
143 S C -1.1256 Soluble
144 K C -1.9267 Soluble
145 S C -1.2035 Soluble
146 T C -0.8324 Soluble
147 S C -0.6979 Soluble
148 G C -0.7921 Soluble
149 G C -0.8880 Soluble
150 T C -0.6003 Soluble
151 A C 0.0000 Buried
152 A C 0.0000 Buried
153 L C 0.0000 Buried
154 G C 0.0000 Buried
155 C C 0.0000 Buried
156 L C 0.0000 Buried
157 V C 0.0000 Buried
158 K C 0.0000 Buried
159 D C -0.7029 Soluble
160 Y C 0.0000 Buried
161 F C 0.0000 Buried
162 P C 0.0000 Buried
163 E C -0.5212 Soluble
164 P C -0.6186 Soluble
165 V C -0.5898 Soluble
166 T C -0.5361 Soluble
167 V C -0.2506 Soluble
168 S C -0.2841 Soluble
169 W C 0.0000 Buried
170 N C -0.6509 Soluble
171 S C -0.5805 Soluble
172 G C -0.3853 Soluble
173 A C -0.2045 Soluble
174 L C 0.0396 Aggregation-prone
175 T C -0.1554 Soluble
176 S C -0.1908 Soluble
177 G C -0.2451 Soluble
178 V C 0.1349 Aggregation-prone
179 H C -0.1506 Soluble
180 T C 0.0276 Aggregation-prone
181 F C 0.0000 Buried
182 P C -0.3133 Soluble
183 A C 0.2391 Aggregation-prone
184 V C 0.4803 Aggregation-prone
185 L C 1.0571 Aggregation-prone
186 Q C 0.2550 Aggregation-prone
187 S C -0.0888 Soluble
188 S C -0.2145 Soluble
189 G C 0.0642 Aggregation-prone
190 L C 0.0583 Aggregation-prone
191 Y C 0.4045 Aggregation-prone
192 S C 0.0000 Buried
193 L C 0.0000 Buried
194 S C 0.0000 Buried
195 S C 0.0000 Buried
196 V C 0.0000 Buried
197 V C 0.0000 Buried
198 T C -0.1772 Soluble
199 V C 0.0000 Buried
200 P C -0.6617 Soluble
201 S C -0.5823 Soluble
202 S C -0.6140 Soluble
203 S C -0.7047 Soluble
204 L C -0.8842 Soluble
205 G C -1.0783 Soluble
206 T C -0.8702 Soluble
207 Q C -1.5804 Soluble
208 T C -1.1773 Soluble
209 Y C 0.0000 Buried
210 I C -0.8104 Soluble
211 C C 0.0000 Buried
212 N C -1.2416 Soluble
213 V C 0.0000 Buried
214 N C -1.7891 Soluble
215 H C 0.0000 Buried
216 K C -2.6999 Soluble
217 P C -1.6202 Soluble
218 S C -1.9233 Soluble
219 N C -2.5795 Soluble
220 T C -2.2044 Soluble
221 K C -2.5896 Soluble
222 V C -1.4692 Soluble
223 D C -2.0478 Soluble
224 K C -1.7553 Soluble
225 K C -1.9091 Soluble
226 V C 0.0000 Buried
227 E C -2.3641 Soluble
228 P C -1.2016 Soluble
1 E B -1.8400 Soluble
2 I B 0.0000 Buried
3 V B 0.6231 Aggregation-prone
4 L B 0.0000 Buried
5 T B -0.6930 Soluble
6 Q B 0.0000 Buried
7 S B -0.7014 Soluble
8 P B -0.2837 Soluble
9 A B -0.3932 Soluble
10 T B -0.2920 Soluble
11 L B -0.2063 Soluble
12 S B -0.5456 Soluble
13 L B -1.1308 Soluble
14 S B -1.5693 Soluble
15 P B -1.9710 Soluble
16 G B -1.7829 Soluble
17 E B -2.3275 Soluble
18 R B -2.5449 Soluble
19 A B 0.0000 Buried
20 T B -0.6583 Soluble
21 L B 0.0000 Buried
22 S B -0.8419 Soluble
23 C B 0.0000 Buried
24 R B -2.2633 Soluble
25 A B 0.0000 Buried
26 S B -1.0459 Soluble
27 Q B -1.7319 Soluble
28 S B -1.3069 Soluble
29 V B 0.0000 Buried
36 S B -0.6698 Soluble
37 S B -0.1821 Soluble
38 Y B 0.1605 Aggregation-prone
39 L B 0.0000 Buried
40 A B 0.0000 Buried
41 W B 0.0000 Buried
42 Y B 0.0000 Buried
43 Q B 0.0000 Buried
44 Q B 0.0000 Buried
45 K B -1.6223 Soluble
46 P B -1.3875 Soluble
47 G B -1.5915 Soluble
48 Q B -2.0172 Soluble
49 A B -1.2513 Soluble
50 P B 0.0000 Buried
51 R B -1.0420 Soluble
52 L B 0.0000 Buried
53 L B 0.0000 Buried
54 I B 0.0000 Buried
55 Y B -0.4421 Soluble
56 D B -0.4577 Soluble
57 A B 0.0000 Buried
65 S B -0.9090 Soluble
66 N B -1.2905 Soluble
67 R B -1.4913 Soluble
68 A B -0.9644 Soluble
69 T B -0.6265 Soluble
70 G B -0.5920 Soluble
71 I B -0.6003 Soluble
72 P B -0.3932 Soluble
74 A B -0.4150 Soluble
75 R B -0.6593 Soluble
76 F B 0.0000 Buried
77 S B -0.6553 Soluble
78 G B -0.6766 Soluble
79 S B -0.7856 Soluble
80 G B -1.1375 Soluble
83 S B -1.0207 Soluble
84 G B -1.1835 Soluble
85 T B -1.8549 Soluble
86 D B -2.3061 Soluble
87 F B 0.0000 Buried
88 T B -0.7907 Soluble
89 L B 0.0000 Buried
90 T B -0.6523 Soluble
91 I B 0.0000 Buried
92 S B -1.5331 Soluble
93 S B -1.6795 Soluble
94 L B 0.0000 Buried
95 E B -2.5228 Soluble
96 P B -2.6424 Soluble
97 E B -2.8042 Soluble
98 D B 0.0000 Buried
99 F B 0.0000 Buried
100 A B 0.0000 Buried
101 V B -0.4387 Soluble
102 Y B 0.0000 Buried
103 Y B 0.0000 Buried
104 C B 0.0000 Buried
105 Q B 0.0000 Buried
106 Q B 0.0000 Buried
107 R B -0.4975 Soluble
108 S B -0.8154 Soluble
109 N B -1.5236 Soluble
114 W B -0.7855 Soluble
115 P B -0.9791 Soluble
116 P B 0.0000 Buried
117 T B 0.0000 Buried
118 F B -0.0129 Soluble
119 G B 0.0000 Buried
120 Q B -1.4483 Soluble
121 G B 0.0000 Buried
122 T B 0.0000 Buried
123 K B -0.9039 Soluble
124 V B 0.0000 Buried
125 E B -1.0754 Soluble
126 I B 0.0000 Buried
127 K B -1.1694 Soluble
128 R B -0.9329 Soluble
129 T B 0.2420 Aggregation-prone
130 V B 1.0532 Aggregation-prone
131 A B 0.2551 Aggregation-prone
132 A B 0.0003 Aggregation-prone
133 P B 0.0000 Buried
134 S B -0.2314 Soluble
135 V B 0.0000 Buried
136 F B 0.0000 Buried
137 I B 0.0000 Buried
138 F B 0.0000 Buried
139 P B -0.6909 Soluble
140 P B -0.8402 Soluble
141 S B -1.5607 Soluble
142 D B -2.7943 Soluble
143 E B -2.6785 Soluble
144 Q B 0.0000 Buried
145 L B -2.1720 Soluble
146 K B -2.6774 Soluble
147 S B -1.6822 Soluble
148 G B -1.3972 Soluble
149 T B -0.9380 Soluble
150 A B 0.0000 Buried
151 S B 0.0000 Buried
152 V B 0.0000 Buried
153 V B 0.0000 Buried
154 C B 0.0000 Buried
155 L B 0.0000 Buried
156 L B 0.0000 Buried
157 N B 0.0000 Buried
158 N B -1.1104 Soluble
159 F B 0.0000 Buried
160 Y B 0.0000 Buried
161 P B -1.3866 Soluble
162 R B -2.5002 Soluble
163 E B -2.9879 Soluble
164 A B -2.1986 Soluble
165 K B -2.2191 Soluble
166 V B -0.9885 Soluble
167 Q B -0.5527 Soluble
168 W B 0.0000 Buried
169 K B -0.5631 Soluble
170 V B 0.0000 Buried
171 D B -2.2747 Soluble
172 N B -1.5668 Soluble
173 A B -0.4662 Soluble
174 L B 0.5450 Aggregation-prone
175 Q B -0.5719 Soluble
176 S B -0.6818 Soluble
177 G B -1.2481 Soluble
178 N B -1.4795 Soluble
179 S B -1.4357 Soluble
180 Q B -1.5036 Soluble
181 E B -1.8446 Soluble
182 S B -0.8501 Soluble
183 V B -0.4670 Soluble
184 T B -1.0007 Soluble
185 E B -2.1459 Soluble
186 Q B 0.0000 Buried
187 D B -2.2826 Soluble
188 S B -2.6172 Soluble
189 K B -3.0520 Soluble
190 D B -2.4436 Soluble
191 S B 0.0000 Buried
192 T B 0.0000 Buried
193 Y B 0.0000 Buried
194 S B 0.0000 Buried
195 L B 0.0000 Buried
196 S B 0.0000 Buried
197 S B 0.0000 Buried
198 T B -0.7666 Soluble
199 L B 0.0000 Buried
200 T B -0.4699 Soluble
201 L B -0.9179 Soluble
202 S B -1.4687 Soluble
203 K B -2.2431 Soluble
204 A B -2.1164 Soluble
205 D B -3.2321 Soluble
206 Y B 0.0000 Buried
207 E B -3.7765 Soluble
208 K B -3.8170 Soluble
209 H B -3.3828 Soluble
210 K B -3.2553 Soluble
211 V B -1.7339 Soluble
212 Y B 0.0000 Buried
213 A B 0.0000 Buried
214 C B 0.0000 Buried
215 E B -0.6083 Soluble
216 V B 0.0000 Buried
217 T B -1.1968 Soluble
218 H B 0.0000 Buried
219 Q B -1.5717 Soluble
220 G B -0.2597 Soluble
221 L B -0.1717 Soluble
222 S B -0.4442 Soluble
223 S B -0.4334 Soluble
224 P B -0.6217 Soluble
225 V B -0.0195 Soluble
226 T B -0.3251 Soluble
227 K B -0.7148 Soluble
228 S B -0.8069 Soluble
229 F B 0.0000 Buried
230 N B -2.0697 Soluble
231 R B -2.3482 Soluble
232 G B -1.4341 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
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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 -0.6595 4.7758 CSV PDB
4.5 -0.7028 4.7691 CSV PDB
5.0 -0.7532 4.7607 CSV PDB
5.5 -0.8012 4.7535 CSV PDB
6.0 -0.8363 4.7509 CSV PDB
6.5 -0.8499 4.7555 CSV PDB
7.0 -0.8418 4.7668 CSV PDB
7.5 -0.8191 4.7821 CSV PDB
8.0 -0.7883 4.7991 CSV PDB
8.5 -0.7512 4.8166 CSV PDB
9.0 -0.7081 4.8342 CSV PDB
Average A4D Score vs pH
Max A4D Score vs pH