Zinlirvimab / 8ttw

A4DAB308_8ttw_Q_R | Source PDB: 8ttw | Chains: Q, R | Done
100
Yes
10 Å
Yes
Avg A4D Score
-0.544
Max Score
2.7981
Min Score
-3.6693
Total Score
-126.21
Score CDR
-0.2586
Score non-CDR
-0.6481

Calculation Parameters

Chain Sequence(s) VQLQESGPGLVKPSETLSVTCSVSGDSMNNYYWTWIRQSPGKGLEWIGYISDRESATYNPSLNSRVVISRDTSKNQLSLKLNSVTPADTAVYYCATARRGQRIYGVVSFGEFFYYYSMDVWGKGTTVTVSLSVALGETARISCGRQALGSRAVQWYQHRPGQAPILLIYNNQDRPSGIPERFSGTPDINFGTRATLTISGVEAGDEADYYCHMWDSRSGFSWSFGGATRLTV input.pdb
Selected Chain(s) Q (Heavy), R (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 -3.6693
Maximum Score 2.7981
Average Score -0.544
Total Score -126.2135

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

Index Residue Chain A4D Score Classification
2 V Q -0.2161 Soluble
3 Q Q -1.4391 Soluble
4 L Q 0.0000 Buried
5 Q Q -1.8958 Soluble
6 E Q -1.4502 Soluble
7 S Q -0.8074 Soluble
8 G Q -0.3830 Soluble
9 P Q 0.0566 Aggregation-prone
11 G Q 0.5450 Aggregation-prone
12 L Q 1.0873 Aggregation-prone
13 V Q -0.4364 Soluble
14 K Q -1.9454 Soluble
15 P Q -1.6895 Soluble
16 S Q -1.9067 Soluble
17 E Q -2.7767 Soluble
18 T Q -1.9223 Soluble
19 L Q 0.0000 Buried
20 S Q -0.7855 Soluble
21 V Q 0.0000 Buried
22 T Q -0.7167 Soluble
23 C Q 0.0000 Buried
24 S Q -1.2437 Soluble
25 V Q 0.0000 Buried
26 S Q -1.1408 Soluble
27 G Q -1.2373 Soluble
28 D Q -2.1918 Soluble
29 S Q -1.5773 Soluble
30 M Q 0.0000 Buried
35 N Q -2.2434 Soluble
36 N Q -2.0501 Soluble
37 Y Q -0.9529 Soluble
38 Y Q -0.7777 Soluble
39 W Q 0.0000 Buried
40 T Q 0.0000 Buried
41 W Q 0.0000 Buried
42 I Q 0.0000 Buried
43 R Q -0.5420 Soluble
44 Q Q -0.9975 Soluble
45 S Q -1.0835 Soluble
46 P Q -1.1179 Soluble
47 G Q -1.4959 Soluble
48 K Q -2.2722 Soluble
49 G Q -1.4973 Soluble
50 L Q 0.0000 Buried
51 E Q -1.0123 Soluble
52 W Q 0.0000 Buried
53 I Q 0.0000 Buried
54 G Q 0.0000 Buried
55 Y Q -0.0436 Soluble
56 I Q 0.0000 Buried
57 S Q -2.2929 Soluble
58 D Q -3.6550 Soluble
59 R Q -3.6693 Soluble
63 E Q -3.4422 Soluble
64 S Q -2.0040 Soluble
65 A Q -0.9196 Soluble
66 T Q -0.0715 Soluble
67 Y Q -0.1681 Soluble
68 N Q 0.0000 Buried
69 P Q -0.6315 Soluble
70 S Q -0.6848 Soluble
71 L Q -1.1244 Soluble
72 N Q -1.9826 Soluble
74 S Q -1.4793 Soluble
75 R Q -2.5391 Soluble
76 V Q 0.0000 Buried
77 V Q 0.0111 Aggregation-prone
78 I Q 0.0000 Buried
79 S Q -0.6470 Soluble
80 R Q -1.2186 Soluble
81 D Q -1.5623 Soluble
82 T Q -1.5471 Soluble
83 S Q -1.4941 Soluble
84 K Q -2.3674 Soluble
85 N Q -2.1200 Soluble
86 Q Q -1.6506 Soluble
87 L Q 0.0000 Buried
88 S Q -0.5608 Soluble
89 L Q 0.0000 Buried
90 K Q -1.3372 Soluble
91 L Q -1.6527 Soluble
92 N Q -2.4534 Soluble
93 S Q -1.7459 Soluble
94 V Q 0.0000 Buried
95 T Q -0.9516 Soluble
96 P Q -0.8994 Soluble
97 A Q -0.2676 Soluble
98 D Q -0.4490 Soluble
99 T Q -0.1096 Soluble
100 A Q 0.0000 Buried
101 V Q -0.1947 Soluble
102 Y Q 0.0000 Buried
103 Y Q 0.0000 Buried
104 C Q 0.0000 Buried
105 A Q 0.0000 Buried
106 T Q 0.0000 Buried
107 A Q 0.0000 Buried
108 R Q -2.0054 Soluble
109 R Q -1.5705 Soluble
110 G Q -1.2271 Soluble
111 Q Q -0.5560 Soluble
111A R Q 0.5018 Aggregation-prone
111B I Q 2.2187 Aggregation-prone
111C Y Q 2.1053 Aggregation-prone
111D G Q 1.9466 Aggregation-prone
111E V Q 2.7943 Aggregation-prone
111F V Q 2.7981 Aggregation-prone
112G S Q 1.6427 Aggregation-prone
112F F Q 2.3930 Aggregation-prone
112E G Q 1.4518 Aggregation-prone
112D E Q 1.5623 Aggregation-prone
112C F Q 1.8747 Aggregation-prone
112B F Q 0.8058 Aggregation-prone
112A Y Q 0.4981 Aggregation-prone
112 Y Q 0.0000 Buried
113 Y Q 0.0000 Buried
114 S Q 0.0000 Buried
115 M Q 0.0000 Buried
116 D Q -1.0277 Soluble
117 V Q -0.1584 Soluble
118 W Q 0.0000 Buried
119 G Q 0.0000 Buried
120 K Q -2.5073 Soluble
121 G Q 0.0000 Buried
122 T Q 0.0000 Buried
123 T Q -0.1459 Soluble
124 V Q 0.0000 Buried
125 T Q 0.1324 Aggregation-prone
126 V Q -0.3792 Soluble
127 S Q -0.4048 Soluble
11 L R 1.0198 Aggregation-prone
12 S R 0.5677 Aggregation-prone
13 V R 0.8645 Aggregation-prone
14 A R 0.5820 Aggregation-prone
15 L R 0.3174 Aggregation-prone
16 G R -1.0724 Soluble
17 E R -1.9687 Soluble
18 T R -1.3709 Soluble
19 A R -1.1725 Soluble
20 R R -1.9044 Soluble
21 I R 0.0000 Buried
22 S R -0.8676 Soluble
23 C R 0.0000 Buried
24 G R -1.1666 Soluble
25 R R -1.2348 Soluble
26 Q R -1.3198 Soluble
27 A R -0.1888 Soluble
28 L R 0.8215 Aggregation-prone
29 G R 0.4103 Aggregation-prone
36 S R 0.8334 Aggregation-prone
37 R R 0.0000 Buried
38 A R 0.0000 Buried
39 V R 0.0000 Buried
40 Q R 0.0000 Buried
41 W R 0.0000 Buried
42 Y R 0.0000 Buried
43 Q R 0.0000 Buried
44 H R 0.0000 Buried
45 R R -1.2295 Soluble
46 P R -1.1461 Soluble
47 G R -1.5698 Soluble
48 Q R -1.9365 Soluble
49 A R -1.1602 Soluble
50 P R 0.0000 Buried
51 I R 0.6987 Aggregation-prone
52 L R 0.0000 Buried
53 L R 0.0000 Buried
54 I R 0.0000 Buried
55 Y R -1.4911 Soluble
56 N R -1.8703 Soluble
57 N R 0.0000 Buried
65 Q R -2.3943 Soluble
66 D R -2.7431 Soluble
67 R R -2.5788 Soluble
68 P R -1.4417 Soluble
69 S R -1.0533 Soluble
70 G R -0.8197 Soluble
71 I R -0.7543 Soluble
72 P R -1.4476 Soluble
74 E R -2.4072 Soluble
75 R R -1.6869 Soluble
76 F R 0.0000 Buried
77 S R -1.5504 Soluble
78 G R -1.3360 Soluble
79 T R -0.4494 Soluble
80 P R -0.7184 Soluble
81 D R 0.0575 Aggregation-prone
81A I R 1.5641 Aggregation-prone
82 N R 0.3709 Aggregation-prone
83 F R 1.7011 Aggregation-prone
84 G R 0.3166 Aggregation-prone
85 T R -0.1197 Soluble
86 R R -0.7199 Soluble
87 A R 0.0000 Buried
88 T R -0.7457 Soluble
89 L R 0.0000 Buried
90 T R -0.9771 Soluble
91 I R 0.0000 Buried
92 S R -1.3289 Soluble
93 G R -1.3241 Soluble
94 V R 0.0000 Buried
95 E R -1.9184 Soluble
96 A R -0.7049 Soluble
97 G R -1.0042 Soluble
98 D R 0.0000 Buried
99 E R -1.6653 Soluble
100 A R 0.0000 Buried
101 D R 0.0000 Buried
102 Y R 0.0000 Buried
103 Y R 0.0000 Buried
104 C R 0.0000 Buried
105 H R 0.0000 Buried
106 M R 0.0000 Buried
107 W R 0.0000 Buried
108 D R 0.0000 Buried
109 S R -0.2184 Soluble
110 R R -1.5356 Soluble
112 S R -0.7500 Soluble
113 G R -0.4882 Soluble
114 F R 0.5209 Aggregation-prone
115 S R 0.0000 Buried
116 W R 0.0979 Aggregation-prone
117 S R -0.3082 Soluble
118 F R 0.0000 Buried
119 G R -0.7005 Soluble
120 G R -1.1624 Soluble
121 A R -1.0022 Soluble
122 T R -0.8245 Soluble
123 R R -1.7844 Soluble
124 L R 0.0000 Buried
125 T R 0.3032 Aggregation-prone
126 V R 1.3707 Aggregation-prone

3D Structure — colored by A4D score

Sequence - click residue to focus in viewer  |  colored by A4D score
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Downloads
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 -0.3949 4.7864 CSV PDB
4.5 -0.4354 4.7572 CSV PDB
5.0 -0.4869 4.7263 CSV PDB
5.5 -0.5403 4.6948 CSV PDB
6.0 -0.5863 4.6632 CSV PDB
6.5 -0.6176 4.6317 CSV PDB
7.0 -0.6326 4.6005 CSV PDB
7.5 -0.6355 4.5704 CSV PDB
8.0 -0.6316 4.5434 CSV PDB
8.5 -0.6229 4.5227 CSV PDB
9.0 -0.6092 4.5106 CSV PDB
Average A4D Score vs pH
Max A4D Score vs pH