Teropavimab / 7pc2

A4DAB261_7pc2_G_H | Source PDB: 7pc2 | Chains: G, H | Done
99.55
Yes
10 Å
Yes
Avg A4D Score
-0.7505
Max Score
1.5798
Min Score
-3.1341
Total Score
-164.36
Score CDR
-0.7129
Score non-CDR
-0.7587

Calculation Parameters

Chain Sequence(s) QVQLLQSGAAVTKPGASVRVSCEASGYNIRDYFIHWWRQAPGQGLQWVGWINPKTGQPNNPRQFQGRVSLTRHASWDFDTYSFYMDLKALRSDDTAVYFCARQRSDYWDFDVWGSGTQVTVDIQMTQSPSSLSASVGDTVTITCQANGYLNWYQQRRGKAPKLLIYDGSKLERGVPSRFSGRRWGQEYNLTINNLQPEDIATYFCQVYEFVVPGTRLDL input.pdb
Selected Chain(s) G (Heavy), H (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 -3.1341
Maximum Score 1.5798
Average Score -0.7505
Total Score -164.3625

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

Index Residue Chain A4D Score Classification
1 Q G -1.3584 Soluble
2 V G -0.6588 Soluble
3 Q G -1.0088 Soluble
4 L G 0.0000 Buried
5 L G 0.6767 Aggregation-prone
6 Q G -0.0480 Soluble
7 S G -0.5754 Soluble
8 G G -0.7488 Soluble
9 A G -0.1653 Soluble
11 A G 0.5281 Aggregation-prone
12 V G 1.5798 Aggregation-prone
13 T G 0.2291 Aggregation-prone
14 K G -1.6465 Soluble
15 P G -1.6981 Soluble
16 G G -1.6089 Soluble
17 A G -1.2332 Soluble
18 S G -1.3346 Soluble
19 V G -0.6992 Soluble
20 R G -1.9080 Soluble
21 V G 0.0000 Buried
22 S G -0.5123 Soluble
23 C G 0.0000 Buried
24 E G -0.5638 Soluble
25 A G 0.0000 Buried
26 S G -1.0872 Soluble
27 G G -1.3005 Soluble
28 Y G -1.2854 Soluble
29 N G -2.0102 Soluble
30 I G 0.0000 Buried
35 R G -2.0927 Soluble
36 D G -2.3989 Soluble
37 Y G -0.8443 Soluble
38 F G -0.0621 Soluble
39 I G 0.0000 Buried
40 H G 0.0000 Buried
41 W G 0.0000 Buried
42 W G 0.0000 Buried
43 R G 0.0000 Buried
44 Q G -0.8403 Soluble
45 A G -1.1594 Soluble
46 P G -0.8605 Soluble
47 G G -1.2586 Soluble
48 Q G -1.7285 Soluble
49 G G -0.9050 Soluble
50 L G 0.0000 Buried
51 Q G -0.5446 Soluble
52 W G 0.0000 Buried
53 V G 0.0000 Buried
54 G G 0.0000 Buried
55 W G -0.1944 Soluble
56 I G 0.0000 Buried
57 N G -1.3268 Soluble
58 P G 0.0000 Buried
59 K G -2.4216 Soluble
62 T G -1.5030 Soluble
63 G G -1.5523 Soluble
64 Q G -1.8229 Soluble
65 P G -1.1320 Soluble
66 N G -1.4580 Soluble
67 N G -1.5357 Soluble
68 P G -1.8903 Soluble
69 R G -3.0206 Soluble
70 Q G -2.5688 Soluble
71 F G 0.0000 Buried
72 Q G -2.5941 Soluble
74 G G -1.7855 Soluble
75 R G -1.4931 Soluble
76 V G -1.2291 Soluble
77 S G -0.9273 Soluble
78 L G 0.0000 Buried
79 T G -0.7113 Soluble
80 R G -1.3877 Soluble
81 H G -1.1170 Soluble
82 A G -0.5026 Soluble
83 S G -0.1341 Soluble
84 W G 0.5650 Aggregation-prone
85 D G -0.8933 Soluble
85A F G 0.4039 Aggregation-prone
85B D G -1.4990 Soluble
85C T G -0.9123 Soluble
85D Y G 0.0000 Buried
86 S G -0.6024 Soluble
87 F G 0.0000 Buried
88 Y G -0.5967 Soluble
89 M G 0.0000 Buried
90 D G -1.1733 Soluble
91 L G 0.0000 Buried
92 K G -2.0049 Soluble
93 A G -1.3469 Soluble
94 L G 0.0000 Buried
95 R G -2.9095 Soluble
96 S G -2.0669 Soluble
97 D G -2.3657 Soluble
98 D G 0.0000 Buried
99 T G -0.7194 Soluble
100 A G 0.0000 Buried
101 V G -0.4377 Soluble
102 Y G 0.0000 Buried
103 F G 0.0000 Buried
104 C G 0.0000 Buried
105 A G 0.0000 Buried
106 R G 0.0000 Buried
107 Q G -0.3599 Soluble
108 R G -0.7408 Soluble
109 S G -0.8827 Soluble
110 D G -1.4837 Soluble
112 Y G -0.1181 Soluble
113 W G -0.0874 Soluble
114 D G 0.0000 Buried
115 F G 0.0000 Buried
116 D G -0.5386 Soluble
117 V G -0.2557 Soluble
118 W G -0.2658 Soluble
119 G G 0.0000 Buried
120 S G -0.6564 Soluble
121 G G -0.6950 Soluble
122 T G 0.0000 Buried
123 Q G -0.8657 Soluble
124 V G 0.3925 Aggregation-prone
125 T G 0.0646 Aggregation-prone
126 V G 0.0008 Aggregation-prone
1 D H -2.0315 Soluble
2 I H -1.1308 Soluble
3 Q H -1.7747 Soluble
4 M H -0.9818 Soluble
5 T H -0.9071 Soluble
6 Q H -0.7320 Soluble
7 S H -0.5695 Soluble
8 P H -0.6205 Soluble
9 S H -0.8461 Soluble
10 S H -1.2092 Soluble
11 L H -0.4613 Soluble
12 S H -0.3021 Soluble
13 A H 0.2082 Aggregation-prone
14 S H 0.6881 Aggregation-prone
15 V H 0.7414 Aggregation-prone
16 G H -1.2073 Soluble
17 D H -2.0982 Soluble
18 T H -1.3216 Soluble
19 V H -0.4841 Soluble
20 T H -0.0750 Soluble
21 I H 0.0000 Buried
22 T H -1.0411 Soluble
23 C H 0.0000 Buried
24 Q H -2.4782 Soluble
25 A H 0.0000 Buried
27 N H -2.4702 Soluble
28 G H -1.1850 Soluble
38 Y H 0.7523 Aggregation-prone
39 L H 0.0000 Buried
40 N H 0.0000 Buried
41 W H 0.0000 Buried
42 Y H 0.0000 Buried
43 Q H 0.0000 Buried
44 Q H 0.0000 Buried
45 R H -2.8292 Soluble
46 R H -3.1341 Soluble
47 G H -2.4739 Soluble
48 K H -3.0300 Soluble
49 A H -1.6694 Soluble
50 P H 0.0000 Buried
51 K H -1.5339 Soluble
52 L H 0.0000 Buried
53 L H 0.0000 Buried
54 I H 0.0000 Buried
55 Y H -0.3731 Soluble
56 D H -0.9853 Soluble
57 G H 0.0000 Buried
65 S H -2.0918 Soluble
66 K H -2.1820 Soluble
67 L H -1.0629 Soluble
68 E H -1.4812 Soluble
69 R H -2.2026 Soluble
70 G H -1.2699 Soluble
71 V H -0.5858 Soluble
72 P H -0.5471 Soluble
74 S H -0.8421 Soluble
75 R H -1.1341 Soluble
76 F H 0.0000 Buried
77 S H -1.0692 Soluble
78 G H -1.8291 Soluble
79 R H -3.0605 Soluble
80 R H -2.9559 Soluble
83 W H -0.8669 Soluble
84 G H -1.2571 Soluble
85 Q H -2.4691 Soluble
86 E H -2.5237 Soluble
87 Y H 0.0000 Buried
88 N H -1.4886 Soluble
89 L H 0.0000 Buried
90 T H -0.5291 Soluble
91 I H 0.0000 Buried
92 N H -2.0886 Soluble
93 N H -2.2091 Soluble
94 L H 0.0000 Buried
95 Q H -1.2303 Soluble
96 P H -0.5658 Soluble
97 E H -1.2948 Soluble
98 D H 0.0000 Buried
99 I H -0.5208 Soluble
100 A H 0.0000 Buried
101 T H -1.3574 Soluble
102 Y H 0.0000 Buried
103 F H 0.0000 Buried
104 C H 0.0000 Buried
105 Q H 0.0000 Buried
106 V H 0.0000 Buried
116 Y H 1.0205 Aggregation-prone
117 E H 0.2599 Aggregation-prone
118 F H 1.1157 Aggregation-prone
119 V H 0.7391 Aggregation-prone
120 V H 0.1411 Aggregation-prone
121 P H -0.8615 Soluble
122 G H -0.9230 Soluble
123 T H 0.0000 Buried
124 R H -2.1583 Soluble
125 L H 0.0000 Buried
126 D H -0.3819 Soluble
127 L H 1.4594 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
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 -0.6009 4.8171 CSV PDB
4.5 -0.6434 4.5074 CSV PDB
5.0 -0.6931 4.1348 CSV PDB
5.5 -0.7426 3.7376 CSV PDB
6.0 -0.7844 3.3394 CSV PDB
6.5 -0.814 3.0584 CSV PDB
7.0 -0.8324 2.7801 CSV PDB
7.5 -0.8441 2.5063 CSV PDB
8.0 -0.8512 2.4234 CSV PDB
8.5 -0.8524 2.4205 CSV PDB
9.0 -0.8447 2.4192 CSV PDB
Average A4D Score vs pH
Max A4D Score vs pH