Beludavimab / 7yqy

A4DAB038_7yqy_I_G | Source PDB: 7yqy | Chains: I, G | Done
99.57
Yes
10 Å
Yes
Avg A4D Score
-0.7404
Max Score
1.5541
Min Score
-3.6474
Total Score
-171.04
Score CDR
-0.2526
Score non-CDR
-0.8893

Calculation Parameters

Chain Sequence(s) QVQLVQSGAEVKKPGASVKVSCKASGYPFTSYGISWVRQAPGQGLEWMGWISTYNGNTNYAQKFQGRVTMTTDTSTTTGYMELRRLRSDDTAVYYCARDYTRGAWFGESLIGGFDNWGQGTLVEIVLTQSPGTLSLSPGERATLSCRASQTVSSTSLAWYQQKPGQAPRLLIYGASSRATGIPDRFSGSGSGTDFTLTISRLEPEDFAVYYCQQHDTSLTFGGGTKVEIKR input.pdb
Selected Chain(s) I (Heavy), G (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 -3.6474
Maximum Score 1.5541
Average Score -0.7404
Total Score -171.0393

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

Index Residue Chain A4D Score Classification
1 Q I -1.2674 Soluble
2 V I -0.6536 Soluble
3 Q I -1.3218 Soluble
4 L I -0.6404 Soluble
5 V I -0.1227 Soluble
6 Q I -0.5866 Soluble
7 S I -0.6971 Soluble
8 G I -0.7843 Soluble
9 A I -0.1472 Soluble
11 E I -0.8304 Soluble
12 V I 0.4912 Aggregation-prone
13 K I -1.4860 Soluble
14 K I -2.3734 Soluble
15 P I -2.6416 Soluble
16 G I -2.1614 Soluble
17 A I -1.9730 Soluble
18 S I -2.0650 Soluble
19 V I 0.0000 Buried
20 K I -2.3478 Soluble
21 V I 0.0000 Buried
22 S I -0.6242 Soluble
23 C I 0.0000 Buried
24 K I -0.7958 Soluble
25 A I 0.0000 Buried
26 S I -0.6668 Soluble
27 G I -0.6864 Soluble
28 Y I -0.3135 Soluble
29 P I -0.1147 Soluble
30 F I 0.0697 Aggregation-prone
35 T I 0.3902 Aggregation-prone
36 S I 0.2825 Aggregation-prone
37 Y I 0.4876 Aggregation-prone
38 G I 0.0000 Buried
39 I I 0.0000 Buried
40 S I 0.0000 Buried
41 W I 0.0000 Buried
42 V I 0.0000 Buried
43 R I -0.5274 Soluble
44 Q I -0.7732 Soluble
45 A I -0.7989 Soluble
46 P I -0.8727 Soluble
47 G I -1.2855 Soluble
48 Q I -1.7627 Soluble
49 G I -1.1547 Soluble
50 L I 0.0000 Buried
51 E I -1.0423 Soluble
52 W I -0.4811 Soluble
53 M I 0.0000 Buried
54 G I 0.0000 Buried
55 W I 0.0000 Buried
56 I I 0.0000 Buried
57 S I 0.0000 Buried
58 T I -0.0635 Soluble
59 Y I 0.8695 Aggregation-prone
62 N I -0.8280 Soluble
63 G I -1.4199 Soluble
64 N I -1.4959 Soluble
65 T I -1.2294 Soluble
66 N I -1.0777 Soluble
67 Y I -1.1409 Soluble
68 A I -1.6086 Soluble
69 Q I -2.5400 Soluble
70 K I -2.6443 Soluble
71 F I -1.7880 Soluble
72 Q I -2.5902 Soluble
74 G I -1.9077 Soluble
75 R I -2.4651 Soluble
76 V I 0.0000 Buried
77 T I -0.7409 Soluble
78 M I -0.3472 Soluble
79 T I -0.3929 Soluble
80 T I -0.6586 Soluble
81 D I -1.2200 Soluble
82 T I -0.5223 Soluble
83 S I -0.6110 Soluble
84 T I -0.6320 Soluble
85 T I -0.7008 Soluble
86 T I 0.0000 Buried
87 G I 0.0000 Buried
88 Y I -0.5827 Soluble
89 M I 0.0000 Buried
90 E I -1.7623 Soluble
91 L I -1.6089 Soluble
92 R I -2.4087 Soluble
93 R I -2.8842 Soluble
94 L I 0.0000 Buried
95 R I -3.6474 Soluble
96 S I -2.4725 Soluble
97 D I -2.7584 Soluble
98 D I -1.5273 Soluble
99 T I -0.6957 Soluble
100 A I 0.0000 Buried
101 V I 0.3792 Aggregation-prone
102 Y I 0.0000 Buried
103 Y I -0.1125 Soluble
104 C I 0.0000 Buried
105 A I 0.0000 Buried
106 R I -0.2642 Soluble
107 D I 0.0000 Buried
108 Y I 0.4448 Aggregation-prone
109 T I 0.0000 Buried
110 R I -0.0944 Soluble
111 G I 0.0000 Buried
111A A I 0.0000 Buried
111B W I 1.2196 Aggregation-prone
111C F I 1.5541 Aggregation-prone
112D G I -0.0793 Soluble
112C E I -0.8286 Soluble
112B S I -0.5729 Soluble
112A L I 0.4541 Aggregation-prone
112 I I 1.2153 Aggregation-prone
113 G I 0.0000 Buried
114 G I 0.0000 Buried
115 F I 0.0000 Buried
116 D I -0.8770 Soluble
117 N I -0.7517 Soluble
118 W I -0.5933 Soluble
119 G I -0.6859 Soluble
120 Q I -1.3069 Soluble
121 G I -0.3044 Soluble
122 T I 0.0000 Buried
123 L I 0.8035 Aggregation-prone
124 V I -0.1471 Soluble
1 E G -1.4352 Soluble
2 I G -0.0902 Soluble
3 V G 1.3097 Aggregation-prone
4 L G 0.3123 Aggregation-prone
5 T G -0.3551 Soluble
6 Q G -0.7528 Soluble
7 S G -0.8310 Soluble
8 P G 0.0000 Buried
9 G G -0.9965 Soluble
10 T G -0.8100 Soluble
11 L G -0.3523 Soluble
12 S G -0.4683 Soluble
13 L G -0.6646 Soluble
14 S G -1.2714 Soluble
15 P G -2.0103 Soluble
16 G G -2.6489 Soluble
17 E G -3.4697 Soluble
18 R G -3.2545 Soluble
19 A G 0.0000 Buried
20 T G -0.7069 Soluble
21 L G 0.0000 Buried
22 S G -0.8724 Soluble
23 C G 0.0000 Buried
24 R G -2.2046 Soluble
25 A G -1.1158 Soluble
26 S G -0.7753 Soluble
27 Q G -1.5643 Soluble
28 T G -1.2930 Soluble
29 V G 0.0000 Buried
30 S G -0.8413 Soluble
36 S G -0.7635 Soluble
37 T G -0.2702 Soluble
38 S G 0.0000 Buried
39 L G 0.0000 Buried
40 A G 0.0000 Buried
41 W G 0.0000 Buried
42 Y G 0.0000 Buried
43 Q G -0.4923 Soluble
44 Q G -0.8147 Soluble
45 K G -1.2436 Soluble
46 P G -0.9894 Soluble
47 G G -1.2387 Soluble
48 Q G -1.7927 Soluble
49 A G -1.1305 Soluble
50 P G 0.0000 Buried
51 R G -1.0100 Soluble
52 L G 0.0000 Buried
53 L G 0.0000 Buried
54 I G 0.0000 Buried
55 Y G 0.1708 Aggregation-prone
56 G G 0.0074 Aggregation-prone
57 A G -0.3523 Soluble
65 S G -0.7820 Soluble
66 S G -1.0754 Soluble
67 R G -2.0395 Soluble
68 A G -1.1607 Soluble
69 T G -0.9733 Soluble
70 G G -1.2754 Soluble
71 I G 0.0000 Buried
72 P G -1.6035 Soluble
74 D G -2.6365 Soluble
75 R G -2.2651 Soluble
76 F G -1.2014 Soluble
77 S G -0.9190 Soluble
78 G G -0.5853 Soluble
79 S G -0.6169 Soluble
80 G G -1.0548 Soluble
83 S G -0.8500 Soluble
84 G G -0.8709 Soluble
85 T G -1.3007 Soluble
86 D G -1.7419 Soluble
87 F G 0.0000 Buried
88 T G -0.7716 Soluble
89 L G 0.0000 Buried
90 T G -0.6232 Soluble
91 I G 0.0000 Buried
92 S G -2.9376 Soluble
93 R G -3.5925 Soluble
94 L G 0.0000 Buried
95 E G -2.4279 Soluble
96 P G -1.7068 Soluble
97 E G -2.0763 Soluble
98 D G -1.3544 Soluble
99 F G -0.7140 Soluble
100 A G 0.0000 Buried
101 V G -0.4036 Soluble
102 Y G 0.0000 Buried
103 Y G 0.0000 Buried
104 C G 0.0000 Buried
105 Q G 0.0000 Buried
106 Q G 0.0000 Buried
107 H G -0.8562 Soluble
108 D G -2.1330 Soluble
114 T G -1.1403 Soluble
115 S G -0.7358 Soluble
116 L G -0.2842 Soluble
117 T G 0.0000 Buried
118 F G 0.2526 Aggregation-prone
119 G G 0.0000 Buried
120 G G -0.9019 Soluble
121 G G -1.1607 Soluble
122 T G 0.0000 Buried
123 K G -1.7740 Soluble
124 V G -0.6372 Soluble
125 E G -0.7298 Soluble
126 I G -0.1208 Soluble
127 K G -1.2896 Soluble
128 R G -1.9566 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 -0.7063 4.7504 CSV PDB
4.5 -0.753 4.6705 CSV PDB
5.0 -0.8092 4.5706 CSV PDB
5.5 -0.8661 4.4671 CSV PDB
6.0 -0.9138 4.376 CSV PDB
6.5 -0.9445 4.3125 CSV PDB
7.0 -0.9566 4.28 CSV PDB
7.5 -0.954 4.2671 CSV PDB
8.0 -0.9414 4.2626 CSV PDB
8.5 -0.9208 4.2611 CSV PDB
9.0 -0.8935 4.2604 CSV PDB
Average A4D Score vs pH
Max A4D Score vs pH