Eltrekibart / 6wzl

A4DAB101_6wzl_C_D | Source PDB: 6wzl | Chains: C, D | Done
100
Yes
10 Å
Yes
Avg A4D Score
-0.6981
Max Score
1.8266
Min Score
-3.4817
Total Score
-303.68
Score CDR
-0.4184
Score non-CDR
-0.7369

Calculation Parameters

Chain Sequence(s) VQLVQSGAEVKKPGASVKVSCKASGYEFTSYWIHWVRQAPGQGLEWMGNISPNSGSANYNEKFKSRVTMTRDTSTSTVYMELSSLRSEDTAVYYCAREGPYSYYPSREYYGSDLWGQGTLVTVSSASTKGPSVFPLAPCSRSSESTAALGCLVKDYFPEPVTVSWNSGALTSGVHTFPAVLQSSGLYSLSSVVTVPSSSLGTKTYTCNVDHKPSNTKVDKRVEIVLTQSPATLSLSPGERATLSCRASQSISNNLHWYQQKPGQAPRLLIYYTSRSVSGIPARFSGSGSGTDFTLTISSLEPEDFAVYYCGQNNEWPEVFGGGTKVEIKRTVAAPSVFIFPPSDEQLKSGTASVVCLLNNFYPREAKVQWKVDNALQSGNSQESVTEQDSKDSTYSLSSTLTLSKADYEKHKVYACEVTHQGLSSPVTKSFNRGE 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 -3.4817
Maximum Score 1.8266
Average Score -0.6981
Total Score -303.6763

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

Index Residue Chain A4D Score Classification
2 V C 1.0842 Aggregation-prone
3 Q C -0.2378 Soluble
4 L C 0.0000 Buried
5 V C -0.0359 Soluble
6 Q C 0.0000 Buried
7 S C -0.5189 Soluble
8 G C -0.3820 Soluble
9 A C 0.3145 Aggregation-prone
11 E C -0.1591 Soluble
12 V C 0.1780 Aggregation-prone
13 K C -1.2227 Soluble
14 K C -2.2323 Soluble
15 P C -1.7375 Soluble
16 G C -1.4079 Soluble
17 A C -1.1278 Soluble
18 S C -1.2328 Soluble
19 V C 0.0000 Buried
20 K C -1.9766 Soluble
21 V C 0.0000 Buried
22 S C -0.6259 Soluble
23 C C 0.0000 Buried
24 K C -1.0362 Soluble
25 A C 0.0000 Buried
26 S C -0.4238 Soluble
27 G C -0.2380 Soluble
28 Y C -0.6199 Soluble
29 E C -1.6787 Soluble
30 F C 0.0000 Buried
35 T C -0.9571 Soluble
36 S C -0.5343 Soluble
37 Y C -0.2044 Soluble
38 W C 0.1860 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 -0.6568 Soluble
45 A C -0.9882 Soluble
46 P C -1.0595 Soluble
47 G C -1.2131 Soluble
48 Q C -1.8118 Soluble
49 G C -1.2261 Soluble
50 L C 0.0000 Buried
51 E C -1.1934 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 -0.6840 Soluble
58 P C 0.0000 Buried
59 N C -1.5612 Soluble
62 S C -1.0411 Soluble
63 G C -0.9982 Soluble
64 S C -0.7675 Soluble
65 A C -0.4385 Soluble
66 N C -0.8884 Soluble
67 Y C -1.2430 Soluble
68 N C -1.9883 Soluble
69 E C -3.2732 Soluble
70 K C -3.0290 Soluble
71 F C 0.0000 Buried
72 K C -2.7223 Soluble
74 S C -1.6201 Soluble
75 R C -1.3067 Soluble
76 V C 0.0000 Buried
77 T C -0.7536 Soluble
78 M C 0.0000 Buried
79 T C -0.4557 Soluble
80 R C -1.1320 Soluble
81 D C -1.2231 Soluble
82 T C -0.8479 Soluble
83 S C -0.5327 Soluble
84 T C -0.6402 Soluble
85 S C -0.9307 Soluble
86 T C 0.0000 Buried
87 V C 0.0000 Buried
88 Y C -0.5748 Soluble
89 M C 0.0000 Buried
90 E C -1.3054 Soluble
91 L C 0.0000 Buried
92 S C -0.9097 Soluble
93 S C -0.9495 Soluble
94 L C 0.0000 Buried
95 R C -2.2846 Soluble
96 S C -1.8798 Soluble
97 E C -2.2917 Soluble
98 D C 0.0000 Buried
99 T C -0.5380 Soluble
100 A C 0.0000 Buried
101 V C 0.6198 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 -0.2440 Soluble
110 Y C 0.6890 Aggregation-prone
111 S C 0.8768 Aggregation-prone
111A Y C 1.8266 Aggregation-prone
111B Y C 1.7868 Aggregation-prone
111C P C 0.0841 Aggregation-prone
112C S C -1.1397 Soluble
112B R C -2.8935 Soluble
112A E C -2.5209 Soluble
112 Y C -0.8828 Soluble
113 Y C 0.1547 Aggregation-prone
114 G C 0.0000 Buried
115 S C 0.0000 Buried
116 D C -0.3403 Soluble
117 L C -0.1519 Soluble
118 W C 0.0000 Buried
119 G C 0.0000 Buried
120 Q C -1.3054 Soluble
121 G C -0.4048 Soluble
122 T C 0.0000 Buried
123 L C 1.3756 Aggregation-prone
124 V C 0.0000 Buried
125 T C -0.2472 Soluble
126 V C 0.0000 Buried
127 S C 0.0000 Buried
128 S C -0.9522 Soluble
129 A C -0.5862 Soluble
130 S C -0.6014 Soluble
131 T C -0.7791 Soluble
132 K C -1.3009 Soluble
133 G C -1.4252 Soluble
134 P C -0.6083 Soluble
135 S C -0.4649 Soluble
136 V C 0.0000 Buried
137 F C 0.0000 Buried
138 P C -0.7559 Soluble
139 L C 0.0000 Buried
140 A C -0.1125 Soluble
141 P C -0.3678 Soluble
142 C C -0.7502 Soluble
143 S C -1.2857 Soluble
144 R C -1.9947 Soluble
145 S C -1.6489 Soluble
146 S C -1.5597 Soluble
147 E C -2.1172 Soluble
148 S C -1.2928 Soluble
149 T C -0.9008 Soluble
150 A C -0.7200 Soluble
151 A C 0.0000 Buried
152 L C 0.0000 Buried
153 G C 0.0000 Buried
154 C C 0.0000 Buried
155 L C 0.0000 Buried
156 V C 0.0000 Buried
157 K C 0.0000 Buried
158 D C -0.5152 Soluble
159 Y C 0.0000 Buried
160 F C 0.0000 Buried
161 P C -0.8434 Soluble
162 E C -1.2453 Soluble
163 P C -1.1220 Soluble
164 V C -0.8140 Soluble
165 T C -0.5815 Soluble
166 V C -0.1888 Soluble
167 S C -0.4763 Soluble
168 W C 0.0000 Buried
169 N C -1.1104 Soluble
170 S C -0.8146 Soluble
171 G C -0.5948 Soluble
172 A C -0.2737 Soluble
173 L C -0.0524 Soluble
174 T C -0.1508 Soluble
175 S C -0.1447 Soluble
176 G C -0.1373 Soluble
177 V C 0.1941 Aggregation-prone
178 H C -0.1010 Soluble
179 T C 0.0102 Aggregation-prone
180 F C 0.0000 Buried
181 P C -0.5042 Soluble
182 A C -0.1666 Soluble
183 V C -0.0317 Soluble
184 L C 0.2155 Aggregation-prone
185 Q C -0.1250 Soluble
186 S C -0.2886 Soluble
187 S C -0.3235 Soluble
188 G C -0.3636 Soluble
189 L C -0.2100 Soluble
190 Y C -0.0888 Soluble
191 S C 0.0000 Buried
192 L C 0.0000 Buried
193 S C 0.0000 Buried
194 S C 0.0000 Buried
195 V C 0.0000 Buried
196 V C 0.0000 Buried
197 T C -0.0849 Soluble
198 V C 0.0000 Buried
199 P C -0.6564 Soluble
200 S C -0.9696 Soluble
201 S C -0.5493 Soluble
202 S C 0.0000 Buried
203 L C -0.6026 Soluble
204 G C -0.9850 Soluble
205 T C -1.0434 Soluble
206 K C -1.8091 Soluble
207 T C -1.2534 Soluble
208 Y C 0.0000 Buried
209 T C -1.5447 Soluble
210 C C 0.0000 Buried
211 N C -1.6716 Soluble
212 V C 0.0000 Buried
213 D C -1.8812 Soluble
214 H C 0.0000 Buried
215 K C -2.8189 Soluble
216 P C -1.7709 Soluble
217 S C -1.8711 Soluble
218 N C -2.6080 Soluble
219 T C -2.1089 Soluble
220 K C -2.7356 Soluble
221 V C -1.8295 Soluble
222 D C -2.7648 Soluble
223 K C -2.2371 Soluble
224 R C -2.3008 Soluble
225 V C -0.6907 Soluble
1 E D -1.5059 Soluble
2 I D -0.2039 Soluble
3 V D 0.9214 Aggregation-prone
4 L D 0.0000 Buried
5 T D -0.6637 Soluble
6 Q D -0.6796 Soluble
7 S D -0.7018 Soluble
8 P D -0.2921 Soluble
9 A D -0.2363 Soluble
10 T D -0.1123 Soluble
11 L D 0.0110 Aggregation-prone
12 S D -0.3505 Soluble
13 L D -0.7572 Soluble
14 S D -1.1202 Soluble
15 P D -1.5090 Soluble
16 G D -1.7019 Soluble
17 E D -2.1804 Soluble
18 R D -2.5951 Soluble
19 A D 0.0000 Buried
20 T D -0.5542 Soluble
21 L D 0.0000 Buried
22 S D -1.0352 Soluble
23 C D 0.0000 Buried
24 R D -2.5464 Soluble
25 A D 0.0000 Buried
26 S D -0.9299 Soluble
27 Q D -1.7358 Soluble
28 S D -1.4643 Soluble
29 I D 0.0000 Buried
36 S D -1.3942 Soluble
37 N D -1.3863 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 -0.9226 Soluble
45 K D -1.6103 Soluble
46 P D -1.4085 Soluble
47 G D -1.5012 Soluble
48 Q D -2.0883 Soluble
49 A D -1.3609 Soluble
50 P D 0.0000 Buried
51 R D -0.9857 Soluble
52 L D 0.0000 Buried
53 L D 0.0000 Buried
54 I D 0.0000 Buried
55 Y D -0.1459 Soluble
56 Y D -0.5642 Soluble
57 T D 0.0000 Buried
65 S D -0.8985 Soluble
66 R D -1.0864 Soluble
67 S D -0.6924 Soluble
68 V D -0.3408 Soluble
69 S D -0.3524 Soluble
70 G D -0.3957 Soluble
71 I D -0.1062 Soluble
72 P D -0.1658 Soluble
74 A D -0.1751 Soluble
75 R D -0.7129 Soluble
76 F D 0.0000 Buried
77 S D -0.5531 Soluble
78 G D -0.5649 Soluble
79 S D -0.9185 Soluble
80 G D -1.4167 Soluble
83 S D -1.2600 Soluble
84 G D -1.7330 Soluble
85 T D -2.2205 Soluble
86 D D -2.9254 Soluble
87 F D 0.0000 Buried
88 T D -0.9345 Soluble
89 L D 0.0000 Buried
90 T D -0.6335 Soluble
91 I D 0.0000 Buried
92 S D -1.3403 Soluble
93 S D -1.7071 Soluble
94 L D 0.0000 Buried
95 E D -2.1385 Soluble
96 P D -1.5267 Soluble
97 E D -2.2829 Soluble
98 D D 0.0000 Buried
99 F D -0.5155 Soluble
100 A D 0.0000 Buried
101 V D 0.0190 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 0.0000 Buried
109 E D -1.2726 Soluble
114 W D -0.3331 Soluble
115 P D -0.9160 Soluble
116 E D 0.0000 Buried
117 V D 0.0836 Aggregation-prone
118 F D 0.0000 Buried
119 G D 0.0000 Buried
120 G D -0.6623 Soluble
121 G D -0.5558 Soluble
122 T D 0.0000 Buried
123 K D -0.2903 Soluble
124 V D 0.0000 Buried
125 E D 0.0000 Buried
126 I D -0.3296 Soluble
127 K D -1.0615 Soluble
128 R D -0.7964 Soluble
129 T D 0.1706 Aggregation-prone
130 V D 0.9622 Aggregation-prone
131 A D 0.4554 Aggregation-prone
132 A D 0.0546 Aggregation-prone
133 P D 0.0000 Buried
134 S D -0.1305 Soluble
135 V D 0.0000 Buried
136 F D 0.0189 Aggregation-prone
137 I D 0.0000 Buried
138 F D 0.0000 Buried
139 P D -0.6158 Soluble
140 P D -0.8190 Soluble
141 S D -1.6563 Soluble
142 D D -3.1247 Soluble
143 E D -3.2810 Soluble
144 Q D 0.0000 Buried
145 L D -2.3448 Soluble
146 K D -2.9793 Soluble
147 S D -1.8674 Soluble
148 G D -1.4843 Soluble
149 T D -1.0628 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 -0.7661 Soluble
159 F D 0.0000 Buried
160 Y D 0.0000 Buried
161 P D -1.5226 Soluble
162 R D -2.9379 Soluble
163 E D -3.1719 Soluble
164 A D -2.2533 Soluble
165 K D -2.2379 Soluble
166 V D -1.0441 Soluble
167 Q D -0.7057 Soluble
168 W D 0.0000 Buried
169 K D -0.8610 Soluble
170 V D 0.0000 Buried
171 D D -1.8970 Soluble
172 N D -1.4541 Soluble
173 A D -0.4882 Soluble
174 L D 0.1995 Aggregation-prone
175 Q D -0.3355 Soluble
176 S D -0.5786 Soluble
177 G D -0.9042 Soluble
178 N D -0.8401 Soluble
179 S D -1.1985 Soluble
180 Q D -1.6306 Soluble
181 E D -2.0276 Soluble
182 S D -0.9147 Soluble
183 V D -0.9045 Soluble
184 T D -1.2167 Soluble
185 E D -2.3093 Soluble
186 Q D -1.8695 Soluble
187 D D -1.9836 Soluble
188 S D -1.6970 Soluble
189 K D -2.2576 Soluble
190 D D -1.6440 Soluble
191 S D -1.6231 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 -0.7203 Soluble
199 L D 0.0000 Buried
200 T D -0.4405 Soluble
201 L D -0.6421 Soluble
202 S D -1.0256 Soluble
203 K D -2.0324 Soluble
204 A D -1.7808 Soluble
205 D D -2.4585 Soluble
206 Y D 0.0000 Buried
207 E D -3.2050 Soluble
208 K D -3.4817 Soluble
209 H D -2.9589 Soluble
210 K D -3.1216 Soluble
211 V D -1.4210 Soluble
212 Y D 0.0000 Buried
213 A D 0.0000 Buried
214 C D 0.0000 Buried
215 E D -0.7960 Soluble
216 V D 0.0000 Buried
217 T D -1.1709 Soluble
218 H D 0.0000 Buried
219 Q D -1.5927 Soluble
220 G D -0.2177 Soluble
221 L D -0.1040 Soluble
222 S D -0.4260 Soluble
223 S D -0.3999 Soluble
224 P D -0.5176 Soluble
225 V D 0.0428 Aggregation-prone
226 T D -0.4701 Soluble
227 K D -0.6853 Soluble
228 S D -0.5934 Soluble
229 F D 0.0000 Buried
230 N D -2.0179 Soluble
231 R D -2.6052 Soluble
232 G D -2.1476 Soluble
233 E D -2.5190 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 -0.7449 2.5351 CSV PDB
4.5 -0.7909 2.5351 CSV PDB
5.0 -0.8473 2.5351 CSV PDB
5.5 -0.9031 2.5351 CSV PDB
6.0 -0.9454 2.535 CSV PDB
6.5 -0.9633 2.535 CSV PDB
7.0 -0.9547 2.5348 CSV PDB
7.5 -0.9271 2.5343 CSV PDB
8.0 -0.8892 2.5327 CSV PDB
8.5 -0.8446 2.5275 CSV PDB
9.0 -0.7948 2.5113 CSV PDB
Average A4D Score vs pH
Max A4D Score vs pH