Eltrekibart / 6wzj

A4DAB101_6wzj_C_D | Source PDB: 6wzj | Chains: C, D | Done
100
Yes
10 Å
Yes
Avg A4D Score
-0.7002
Max Score
1.8568
Min Score
-3.5526
Total Score
-304.59
Score CDR
-0.4935
Score non-CDR
-0.7289

Calculation Parameters

Chain Sequence(s) QVQLVQSGAEVKKPGASVKVSCKASGYEFTSYWIHWVRQAPGQGLEWMGNISPNSGSANYNEKFKSRVTMTRDTSTSTVYMELSSLRSEDTAVYYCAREGPYSYYPSREYYGSDLWGQGTLVTVSSASTKGPSVFPLAPCSRSESTAALGCLVKDYFPEPVTVSWNSGALTSGVHTFPAVLQSSGLYSLSSVVTVPSSSLGTKTYTCNVDHKPSNTKVDKRVEIVLTQSPATLSLSPGERATLSCRASQSISNNLHWYQQKPGQAPRLLIYYTSRSVSGIPARFSGSGSGTDFTLTISSLEPEDFAVYYCGQNNEWPEVFGGGTKVEIKRTVAAPSVFIFPPSDEQLKSGTASVVCLLNNFYPREAKVQWKVDNALQSGNSQESVTEQDSKDSTYSLSSTLTLSKADYEKHKVYACEVTHQGLSSPVTKSFNRGE input.pdb
Selected Chain(s) C (Heavy), D (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 -3.5526
Maximum Score 1.8568
Average Score -0.7002
Total Score -304.5909

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

Index Residue Chain A4D Score Classification
1 Q C -1.1015 Soluble
2 V C -0.1609 Soluble
3 Q C -0.4780 Soluble
4 L C 0.0000 Buried
5 V C 0.5201 Aggregation-prone
6 Q C 0.0000 Buried
7 S C -0.4752 Soluble
8 G C -0.4198 Soluble
9 A C 0.0919 Aggregation-prone
11 E C -0.4569 Soluble
12 V C 0.2024 Aggregation-prone
13 K C -1.2388 Soluble
14 K C -2.2810 Soluble
15 P C -1.9342 Soluble
16 G C -1.4892 Soluble
17 A C -1.1972 Soluble
18 S C -1.3627 Soluble
19 V C 0.0000 Buried
20 K C -2.0790 Soluble
21 V C 0.0000 Buried
22 S C -0.6291 Soluble
23 C C 0.0000 Buried
24 K C -0.8312 Soluble
25 A C 0.0000 Buried
26 S C -0.7464 Soluble
27 G C -0.9659 Soluble
28 Y C -0.9472 Soluble
29 E C -1.6966 Soluble
30 F C -1.0313 Soluble
35 T C -0.9018 Soluble
36 S C -0.5128 Soluble
37 Y C -0.2198 Soluble
38 W C 0.1826 Aggregation-prone
39 I C 0.0000 Buried
40 H 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 -0.5535 Soluble
45 A C -0.9515 Soluble
46 P C -0.9596 Soluble
47 G C -1.2154 Soluble
48 Q C -1.7409 Soluble
49 G C -1.1021 Soluble
50 L C 0.0000 Buried
51 E C -0.5805 Soluble
52 W C 0.0000 Buried
53 M C 0.0000 Buried
54 G C 0.0000 Buried
55 N C 0.0000 Buried
56 I C 0.0000 Buried
57 S C -0.5986 Soluble
58 P C 0.0000 Buried
59 N C -1.4967 Soluble
62 S C -1.0158 Soluble
63 G C -1.0056 Soluble
64 S C -0.6904 Soluble
65 A C -0.3143 Soluble
66 N C -0.6286 Soluble
67 Y C -1.1168 Soluble
68 N C -1.9145 Soluble
69 E C -3.3763 Soluble
70 K C -3.1474 Soluble
71 F C 0.0000 Buried
72 K C -3.1080 Soluble
74 S C -1.7961 Soluble
75 R C -1.6198 Soluble
76 V C 0.0000 Buried
77 T C -0.8847 Soluble
78 M C 0.0000 Buried
79 T C -0.5889 Soluble
80 R C -1.3105 Soluble
81 D C -1.4285 Soluble
82 T C -0.9484 Soluble
83 S C -0.5863 Soluble
84 T C -0.6959 Soluble
85 S C -0.9565 Soluble
86 T C 0.0000 Buried
87 V C 0.0000 Buried
88 Y C -0.8085 Soluble
89 M C 0.0000 Buried
90 E C -1.5041 Soluble
91 L C 0.0000 Buried
92 S C -1.0784 Soluble
93 S C -1.1190 Soluble
94 L C 0.0000 Buried
95 R C -2.6260 Soluble
96 S C -2.1185 Soluble
97 E C -2.4239 Soluble
98 D C 0.0000 Buried
99 T C -0.7370 Soluble
100 A C 0.0000 Buried
101 V C 0.3630 Aggregation-prone
102 Y C 0.0000 Buried
103 Y C 0.0000 Buried
104 C C 0.0000 Buried
105 A C 0.0000 Buried
106 R C 0.0000 Buried
107 E C 0.0000 Buried
108 G C 0.0000 Buried
109 P C -0.1864 Soluble
110 Y C 0.7683 Aggregation-prone
111 S C 0.9329 Aggregation-prone
111A Y C 1.8568 Aggregation-prone
111B Y C 1.8207 Aggregation-prone
111C P C 0.1116 Aggregation-prone
112C S C -1.1729 Soluble
112B R C -2.8357 Soluble
112A E C -2.6198 Soluble
112 Y C -0.9490 Soluble
113 Y C -0.1026 Soluble
114 G C 0.0000 Buried
115 S C 0.0000 Buried
116 D C -0.6096 Soluble
117 L C -0.3882 Soluble
118 W C 0.0000 Buried
119 G C 0.0000 Buried
120 Q C -1.1866 Soluble
121 G C -0.4550 Soluble
122 T C 0.0000 Buried
123 L C 0.8494 Aggregation-prone
124 V C 0.0000 Buried
125 T C -0.4602 Soluble
126 V C 0.0000 Buried
127 S C -0.9486 Soluble
128 S C -0.9256 Soluble
129 A C -0.5779 Soluble
130 S C -0.5722 Soluble
131 T C -0.8001 Soluble
132 K C -1.2751 Soluble
133 G C -1.4043 Soluble
134 P C -0.6598 Soluble
135 S C -0.2747 Soluble
136 V C 0.0000 Buried
137 F C 0.0000 Buried
138 P C -0.7190 Soluble
139 L C 0.0000 Buried
140 A C -0.0322 Soluble
141 P C -0.3373 Soluble
142 C C -0.8039 Soluble
143 S C -1.2922 Soluble
144 R C -2.1796 Soluble
145 S C -1.8397 Soluble
146 E C -2.3061 Soluble
147 S C -1.2386 Soluble
148 T C -0.8198 Soluble
149 A C -0.6759 Soluble
150 A C 0.0000 Buried
151 L C 0.0000 Buried
152 G C 0.0000 Buried
153 C C 0.0000 Buried
154 L C 0.0000 Buried
155 V C 0.0000 Buried
156 K C 0.0000 Buried
157 D C -0.4721 Soluble
158 Y C 0.0000 Buried
159 F C 0.0000 Buried
160 P C -1.0724 Soluble
161 E C -1.5624 Soluble
162 P C -1.4111 Soluble
163 V C 0.0000 Buried
164 T C -0.8063 Soluble
165 V C -0.2722 Soluble
166 S C -0.5218 Soluble
167 W C 0.0000 Buried
168 N C -1.0904 Soluble
169 S C -0.8302 Soluble
170 G C -0.6215 Soluble
171 A C -0.2871 Soluble
172 L C -0.1236 Soluble
173 T C -0.2012 Soluble
174 S C -0.3614 Soluble
175 G C -0.1981 Soluble
176 V C 0.1786 Aggregation-prone
177 H C 0.0000 Buried
178 T C 0.0705 Aggregation-prone
179 F C 0.0000 Buried
180 P C -0.3580 Soluble
181 A C -0.0478 Soluble
182 V C 0.2931 Aggregation-prone
183 L C 0.9022 Aggregation-prone
184 Q C 0.1062 Aggregation-prone
185 S C -0.0878 Soluble
186 S C -0.2341 Soluble
187 G C -0.0080 Soluble
188 L C -0.1234 Soluble
189 Y C 0.0000 Buried
190 S C -0.0467 Soluble
191 L C 0.0000 Buried
192 S C 0.0000 Buried
193 S C 0.0000 Buried
194 V C 0.0000 Buried
195 V C 0.0000 Buried
196 T C -0.1092 Soluble
197 V C 0.0000 Buried
198 P C -0.6036 Soluble
199 S C -0.9308 Soluble
200 S C -0.6392 Soluble
201 S C -0.5461 Soluble
202 L C -0.3861 Soluble
203 G C -0.6391 Soluble
204 T C -0.8462 Soluble
205 K C -1.5227 Soluble
206 T C -1.1381 Soluble
207 Y C 0.0000 Buried
208 T C -1.5663 Soluble
209 C C 0.0000 Buried
210 N C -1.7653 Soluble
211 V C 0.0000 Buried
212 D C -2.0738 Soluble
213 H C 0.0000 Buried
214 K C -2.9082 Soluble
215 P C -1.8090 Soluble
216 S C -1.8354 Soluble
217 N C -2.6348 Soluble
218 T C -2.1170 Soluble
219 K C -2.7680 Soluble
220 V C -1.6584 Soluble
221 D C -2.7762 Soluble
222 K C -2.0842 Soluble
223 R C -2.2941 Soluble
224 V C -0.6842 Soluble
1 E D -1.6629 Soluble
2 I D 0.0000 Buried
3 V D 0.8084 Aggregation-prone
4 L D 0.0000 Buried
5 T D -0.4938 Soluble
6 Q D -0.5870 Soluble
7 S D -0.6105 Soluble
8 P D -0.2946 Soluble
9 A D -0.2115 Soluble
10 T D -0.1136 Soluble
11 L D -0.0315 Soluble
12 S D -0.4718 Soluble
13 L D -0.9498 Soluble
14 S D -1.3240 Soluble
15 P D -1.6136 Soluble
16 G D -1.7339 Soluble
17 E D -2.3066 Soluble
18 R D -2.5461 Soluble
19 A D 0.0000 Buried
20 T D -0.6464 Soluble
21 L D 0.0000 Buried
22 S D -0.6867 Soluble
23 C D 0.0000 Buried
24 R D -1.9218 Soluble
25 A D 0.0000 Buried
26 S D -0.9402 Soluble
27 Q D -1.6727 Soluble
28 S D -1.4276 Soluble
29 I D 0.0000 Buried
36 S D -1.3145 Soluble
37 N D -1.2152 Soluble
38 N D 0.0000 Buried
39 L D 0.0000 Buried
40 H D 0.0000 Buried
41 W D 0.0000 Buried
42 Y D 0.0000 Buried
43 Q D 0.0000 Buried
44 Q D 0.0000 Buried
45 K D -1.3294 Soluble
46 P D -1.2271 Soluble
47 G D -1.4157 Soluble
48 Q D -2.1011 Soluble
49 A D -1.4318 Soluble
50 P D 0.0000 Buried
51 R D -1.5967 Soluble
52 L D 0.0000 Buried
53 L D 0.0000 Buried
54 I D 0.0000 Buried
55 Y D -0.4586 Soluble
56 Y D -0.7498 Soluble
57 T D 0.0000 Buried
65 S D -1.2581 Soluble
66 R D -1.9119 Soluble
67 S D -1.0892 Soluble
68 V D -0.5000 Soluble
69 S D -0.3793 Soluble
70 G D -0.4211 Soluble
71 I D -0.2143 Soluble
72 P D -0.2413 Soluble
74 A D -0.1937 Soluble
75 R D -0.6787 Soluble
76 F D 0.0000 Buried
77 S D -0.6946 Soluble
78 G D -0.7043 Soluble
79 S D -0.8240 Soluble
80 G D -0.8915 Soluble
83 S D -0.8822 Soluble
84 G D -1.0749 Soluble
85 T D -1.4228 Soluble
86 D D -1.5943 Soluble
87 F D 0.0000 Buried
88 T D -0.6193 Soluble
89 L D 0.0000 Buried
90 T D -0.6186 Soluble
91 I D 0.0000 Buried
92 S D -1.3037 Soluble
93 S D -1.6693 Soluble
94 L D 0.0000 Buried
95 E D -1.8911 Soluble
96 P D -1.5328 Soluble
97 E D -2.2257 Soluble
98 D D 0.0000 Buried
99 F D -0.4753 Soluble
100 A D 0.0000 Buried
101 V D 0.1160 Aggregation-prone
102 Y D 0.0000 Buried
103 Y D 0.0000 Buried
104 C D 0.0000 Buried
105 G D 0.0000 Buried
106 Q D 0.0000 Buried
107 N D 0.0000 Buried
108 N D -1.4285 Soluble
109 E D -1.5208 Soluble
114 W D -0.3232 Soluble
115 P D -0.8029 Soluble
116 E D 0.0000 Buried
117 V D 0.1435 Aggregation-prone
118 F D 0.0000 Buried
119 G D 0.0000 Buried
120 G D -0.5730 Soluble
121 G D -0.5307 Soluble
122 T D 0.0000 Buried
123 K D -0.2441 Soluble
124 V D 0.0000 Buried
125 E D 0.0000 Buried
126 I D -0.5183 Soluble
127 K D -1.4002 Soluble
128 R D -0.9501 Soluble
129 T D 0.1386 Aggregation-prone
130 V D 0.9844 Aggregation-prone
131 A D 0.3058 Aggregation-prone
132 A D 0.0828 Aggregation-prone
133 P D 0.0000 Buried
134 S D -0.0286 Soluble
135 V D 0.1376 Aggregation-prone
136 F D 0.2040 Aggregation-prone
137 I D 0.1346 Aggregation-prone
138 F D 0.0000 Buried
139 P D -0.4397 Soluble
140 P D -0.7892 Soluble
141 S D -1.6876 Soluble
142 D D -3.1285 Soluble
143 E D -3.2485 Soluble
144 Q D 0.0000 Buried
145 L D -2.2849 Soluble
146 K D -2.9320 Soluble
147 S D -1.8070 Soluble
148 G D -1.2306 Soluble
149 T D -1.2248 Soluble
150 A D 0.0000 Buried
151 S D 0.0000 Buried
152 V D 0.0000 Buried
153 V D 0.0000 Buried
154 C D 0.0000 Buried
155 L D 0.0000 Buried
156 L D 0.0000 Buried
157 N D 0.0000 Buried
158 N D -0.7115 Soluble
159 F D 0.0000 Buried
160 Y D 0.0000 Buried
161 P D -1.5252 Soluble
162 R D -2.8305 Soluble
163 E D -3.0635 Soluble
164 A D -2.0267 Soluble
165 K D -1.7937 Soluble
166 V D -0.7060 Soluble
167 Q D -0.2650 Soluble
168 W D 0.0000 Buried
169 K D -0.5023 Soluble
170 V D 0.0000 Buried
171 D D -1.8212 Soluble
172 N D -1.3214 Soluble
173 A D -0.2211 Soluble
174 L D 0.8303 Aggregation-prone
175 Q D 0.0153 Aggregation-prone
176 S D -0.4975 Soluble
177 G D -0.9652 Soluble
178 N D -0.9005 Soluble
179 S D -1.3208 Soluble
180 Q D -1.9034 Soluble
181 E D -1.9216 Soluble
182 S D -0.8084 Soluble
183 V D -0.6925 Soluble
184 T D -1.1285 Soluble
185 E D -2.2368 Soluble
186 Q D -1.8028 Soluble
187 D D -1.8912 Soluble
188 S D -1.7041 Soluble
189 K D -2.2627 Soluble
190 D D -1.6528 Soluble
191 S D -1.6560 Soluble
192 T D 0.0000 Buried
193 Y D 0.0000 Buried
194 S D 0.0000 Buried
195 L D 0.0000 Buried
196 S D 0.0000 Buried
197 S D 0.0000 Buried
198 T D -0.7479 Soluble
199 L D 0.0000 Buried
200 T D -0.5612 Soluble
201 L D -0.7265 Soluble
202 S D -1.1070 Soluble
203 K D -2.1215 Soluble
204 A D -1.9223 Soluble
205 D D -2.7557 Soluble
206 Y D 0.0000 Buried
207 E D -3.3220 Soluble
208 K D -3.5526 Soluble
209 H D -2.8890 Soluble
210 K D -2.9493 Soluble
211 V D -1.3785 Soluble
212 Y D 0.0000 Buried
213 A D -0.7860 Soluble
214 C D 0.0000 Buried
215 E D -0.6479 Soluble
216 V D 0.0000 Buried
217 T D -0.9666 Soluble
218 H D 0.0000 Buried
219 Q D -1.5330 Soluble
220 G D -0.2096 Soluble
221 L D -0.1318 Soluble
222 S D -0.4388 Soluble
223 S D -0.4222 Soluble
224 P D -0.4429 Soluble
225 V D 0.1191 Aggregation-prone
226 T D -0.3321 Soluble
227 K D -0.6060 Soluble
228 S D -0.6070 Soluble
229 F D 0.0000 Buried
230 N D -1.9835 Soluble
231 R D -2.5968 Soluble
232 G D -2.3355 Soluble
233 E D -2.5376 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 -0.7553 2.5756 CSV PDB
4.5 -0.7999 2.5756 CSV PDB
5.0 -0.8545 2.5756 CSV PDB
5.5 -0.9077 2.5756 CSV PDB
6.0 -0.9473 2.5756 CSV PDB
6.5 -0.963 2.5756 CSV PDB
7.0 -0.9528 2.5755 CSV PDB
7.5 -0.9243 2.5751 CSV PDB
8.0 -0.8861 2.574 CSV PDB
8.5 -0.8421 2.5706 CSV PDB
9.0 -0.7937 2.5598 CSV PDB
Average A4D Score vs pH
Max A4D Score vs pH