Teropavimab / 7ly9

A4DAB261_7ly9_A_M | Source PDB: 7ly9 | Chains: A, M | Done
99.55
Yes
10 Å
Yes
Avg A4D Score
-0.7523
Max Score
1.6409
Min Score
-3.4263
Total Score
-163.25
Score CDR
-0.7338
Score non-CDR
-0.7564

Calculation Parameters

Chain Sequence(s) QVQLLQSGAAVTKPGASVRVSCEASGYNIRDYFIHWWRQAPGQGLQWVGWINPKTGQPNNPRQFQGRVSLTRHASWDFDTYSFYMDLKALRSDDTAVYFCARQRSDYWDFDVWGSGTQVTVDIQMTQSPSSLSASVGDTVTITCQANGYLNWYQQRRGKAPKLLIYDGSKLERGVPSRFSGRRWGQEYNLTINNLQPEDIATYFCQVYEFVVPGTRL input.pdb
Selected Chain(s) A (Heavy), M (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 -3.4263
Maximum Score 1.6409
Average Score -0.7523
Total Score -163.2516

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

Index Residue Chain A4D Score Classification
1 Q A -1.3865 Soluble
2 V A -0.8981 Soluble
3 Q A -1.0926 Soluble
4 L A 0.0000 Buried
5 L A 0.5328 Aggregation-prone
6 Q A -0.0781 Soluble
7 S A -0.4823 Soluble
8 G A -0.6043 Soluble
9 A A -0.1240 Soluble
11 A A 0.4646 Aggregation-prone
12 V A 1.3850 Aggregation-prone
13 T A 0.0424 Aggregation-prone
14 K A -1.6094 Soluble
15 P A -1.4638 Soluble
16 G A -1.6694 Soluble
17 A A -1.3584 Soluble
18 S A -1.4008 Soluble
19 V A 0.0000 Buried
20 R A -1.5923 Soluble
21 V A 0.0000 Buried
22 S A -0.5088 Soluble
23 C A 0.0000 Buried
24 E A -0.7912 Soluble
25 A A 0.0000 Buried
26 S A -0.8589 Soluble
27 G A -1.2005 Soluble
28 Y A -1.3478 Soluble
29 N A -1.8835 Soluble
30 I A 0.0000 Buried
35 R A -2.3742 Soluble
36 D A -2.6435 Soluble
37 Y A -1.1052 Soluble
38 F A -0.1335 Soluble
39 I A 0.0000 Buried
40 H A 0.0000 Buried
41 W A 0.0000 Buried
42 W A 0.0000 Buried
43 R A -0.5489 Soluble
44 Q A -0.8073 Soluble
45 A A -1.1311 Soluble
46 P A -1.0873 Soluble
47 G A -1.2547 Soluble
48 Q A -1.7133 Soluble
49 G A -0.7835 Soluble
50 L A 0.0000 Buried
51 Q A -0.2616 Soluble
52 W A 0.1624 Aggregation-prone
53 V A 0.0000 Buried
54 G A 0.0000 Buried
55 W A -0.1847 Soluble
56 I A 0.0000 Buried
57 N A -1.4778 Soluble
58 P A 0.0000 Buried
59 K A -2.5443 Soluble
62 T A -1.6354 Soluble
63 G A -1.6409 Soluble
64 Q A -1.8596 Soluble
65 P A -1.1690 Soluble
66 N A -1.4043 Soluble
67 N A -1.4973 Soluble
68 P A -1.8741 Soluble
69 R A -3.0581 Soluble
70 Q A -2.6251 Soluble
71 F A 0.0000 Buried
72 Q A -2.7221 Soluble
74 G A -1.9628 Soluble
75 R A -1.7794 Soluble
76 V A 0.0000 Buried
77 S A -0.9087 Soluble
78 L A 0.0000 Buried
79 T A -0.7903 Soluble
80 R A -1.4900 Soluble
81 H A -1.1483 Soluble
82 A A -0.6185 Soluble
83 S A -0.1745 Soluble
84 W A 0.4592 Aggregation-prone
85 D A -0.6937 Soluble
85A F A 0.4390 Aggregation-prone
85B D A -1.1579 Soluble
85C T A -0.9011 Soluble
85D Y A 0.0000 Buried
86 S A -0.8067 Soluble
87 F A 0.0000 Buried
88 Y A -0.6513 Soluble
89 M A 0.0000 Buried
90 D A -1.3380 Soluble
91 L A 0.0000 Buried
92 K A -2.4471 Soluble
93 A A -1.6647 Soluble
94 L A 0.0000 Buried
95 R A -2.8880 Soluble
96 S A -2.0951 Soluble
97 D A -2.3859 Soluble
98 D A 0.0000 Buried
99 T A -0.6967 Soluble
100 A A 0.0000 Buried
101 V A -0.3154 Soluble
102 Y A 0.0000 Buried
103 F A 0.0000 Buried
104 C A 0.0000 Buried
105 A A 0.0000 Buried
106 R A 0.0000 Buried
107 Q A -0.4823 Soluble
108 R A -0.8909 Soluble
109 S A -1.1089 Soluble
110 D A -1.6921 Soluble
112 Y A -0.5617 Soluble
113 W A -0.2588 Soluble
114 D A 0.0000 Buried
115 F A 0.0000 Buried
116 D A -1.0707 Soluble
117 V A -0.5508 Soluble
118 W A -0.4481 Soluble
119 G A 0.0000 Buried
120 S A -0.5654 Soluble
121 G A -0.6379 Soluble
122 T A 0.0000 Buried
123 Q A -0.6891 Soluble
124 V A 0.0000 Buried
125 T A 0.2177 Aggregation-prone
126 V A -0.2711 Soluble
1 D M -1.6563 Soluble
2 I M -0.4014 Soluble
3 Q M -1.1059 Soluble
4 M M -0.4662 Soluble
5 T M -0.4469 Soluble
6 Q M -0.4347 Soluble
7 S M -0.5031 Soluble
8 P M -0.5598 Soluble
9 S M -0.7487 Soluble
10 S M -0.8428 Soluble
11 L M -0.4349 Soluble
12 S M -0.1478 Soluble
13 A M 0.1457 Aggregation-prone
14 S M 0.2223 Aggregation-prone
15 V M 0.6085 Aggregation-prone
16 G M -1.0205 Soluble
17 D M -1.0553 Soluble
18 T M -0.8748 Soluble
19 V M 0.0000 Buried
20 T M -0.3220 Soluble
21 I M 0.0000 Buried
22 T M -0.7407 Soluble
23 C M 0.0000 Buried
24 Q M -1.4384 Soluble
25 A M 0.0000 Buried
27 N M -1.3341 Soluble
28 G M -0.4303 Soluble
38 Y M 0.2493 Aggregation-prone
39 L M 0.0000 Buried
40 N M 0.0000 Buried
41 W M 0.0000 Buried
42 Y M 0.0000 Buried
43 Q M -1.3427 Soluble
44 Q M 0.0000 Buried
45 R M -3.4263 Soluble
46 R M -3.1971 Soluble
47 G M -2.6178 Soluble
48 K M -3.1747 Soluble
49 A M -1.8586 Soluble
50 P M 0.0000 Buried
51 K M -2.1325 Soluble
52 L M 0.0000 Buried
53 L M 0.0000 Buried
54 I M 0.0000 Buried
55 Y M -0.3074 Soluble
56 D M -0.9921 Soluble
57 G M 0.0000 Buried
65 S M -1.8704 Soluble
66 K M -1.5147 Soluble
67 L M -0.6484 Soluble
68 E M -1.2259 Soluble
69 R M -2.1828 Soluble
70 G M -1.2991 Soluble
71 V M -0.9245 Soluble
72 P M -0.7704 Soluble
74 S M -0.7948 Soluble
75 R M -1.0051 Soluble
76 F M 0.0000 Buried
77 S M -0.8855 Soluble
78 G M -1.7318 Soluble
79 R M -3.0353 Soluble
80 R M -2.8321 Soluble
83 W M -0.9019 Soluble
84 G M -1.0475 Soluble
85 Q M -2.0005 Soluble
86 E M -2.0668 Soluble
87 Y M 0.0000 Buried
88 N M -1.5909 Soluble
89 L M 0.0000 Buried
90 T M -0.7726 Soluble
91 I M 0.0000 Buried
92 N M -1.7807 Soluble
93 N M -2.0744 Soluble
94 L M 0.0000 Buried
95 Q M -1.8291 Soluble
96 P M -1.4551 Soluble
97 E M -2.3749 Soluble
98 D M -1.5286 Soluble
99 I M -0.4564 Soluble
100 A M 0.0000 Buried
101 T M 0.0000 Buried
102 Y M 0.0000 Buried
103 F M 0.0000 Buried
104 C M 0.0000 Buried
105 Q M 0.0000 Buried
106 V M 0.0000 Buried
116 Y M 1.0494 Aggregation-prone
117 E M 0.7011 Aggregation-prone
118 F M 1.6409 Aggregation-prone
119 V M 0.9584 Aggregation-prone
120 V M 0.2365 Aggregation-prone
121 P M -0.8991 Soluble
122 G M -0.8818 Soluble
123 T M 0.0000 Buried
124 R M -1.8410 Soluble
125 L M -0.5015 Soluble

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
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 -0.6008 4.7123 CSV PDB
4.5 -0.6415 4.4507 CSV PDB
5.0 -0.6883 4.1309 CSV PDB
5.5 -0.7333 3.7861 CSV PDB
6.0 -0.7692 3.6669 CSV PDB
6.5 -0.7924 3.6083 CSV PDB
7.0 -0.8049 3.5622 CSV PDB
7.5 -0.8109 3.5347 CSV PDB
8.0 -0.8127 3.5225 CSV PDB
8.5 -0.8093 3.5179 CSV PDB
9.0 -0.7974 3.516 CSV PDB
Average A4D Score vs pH
Max A4D Score vs pH