Teropavimab / 5v8l

A4DAB261_5v8l_G_K | Source PDB: 5v8l | Chains: G, K | Done
99.55
Yes
10 Å
Yes
Avg A4D Score
-0.775
Max Score
1.56
Min Score
-3.1875
Total Score
-169.73
Score CDR
-0.7777
Score non-CDR
-0.7744

Calculation Parameters

Chain Sequence(s) QVQLLQSGAAVTKPGASVRVSCEASGYNIRDYFIHWWRQAPGQGLQWVGWINPKTGQPNNPRQFQGRVSLTRHASWDFDTYSFYMDLKALRSDDTAVYFCARQRSDYWDFDVWGSGTQVTVDIQMTQSPSSLSASVGDTVTITCQANGYLNWYQQRRGKAPKLLIYDGSKLERGVPSRFSGRRWGQEYNLTINNLQPEDIATYFCQVYEFVVPGTRLDL input.pdb
Selected Chain(s) G (Heavy), K (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 -3.1875
Maximum Score 1.56
Average Score -0.775
Total Score -169.7302

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

Index Residue Chain A4D Score Classification
1 Q G -1.2871 Soluble
2 V G -0.5712 Soluble
3 Q G -0.8760 Soluble
4 L G 0.0000 Buried
5 L G 0.6387 Aggregation-prone
6 Q G -0.1082 Soluble
7 S G -0.4960 Soluble
8 G G -0.4962 Soluble
9 A G 0.0644 Aggregation-prone
11 A G 0.5968 Aggregation-prone
12 V G 1.5600 Aggregation-prone
13 T G -0.1067 Soluble
14 K G -1.6905 Soluble
15 P G -1.8183 Soluble
16 G G -1.7295 Soluble
17 A G -1.3900 Soluble
18 S G -1.5601 Soluble
19 V G -1.1719 Soluble
20 R G -1.9915 Soluble
21 V G 0.0000 Buried
22 S G -0.5679 Soluble
23 C G 0.0000 Buried
24 E G -0.6868 Soluble
25 A G 0.0000 Buried
26 S G -0.9042 Soluble
27 G G -1.3728 Soluble
28 Y G -1.3373 Soluble
29 N G -2.1860 Soluble
30 I G 0.0000 Buried
35 R G -2.7819 Soluble
36 D G -2.8056 Soluble
37 Y G -1.4488 Soluble
38 F G -0.1171 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 -0.5286 Soluble
44 Q G -0.7890 Soluble
45 A G -1.0900 Soluble
46 P G -0.8893 Soluble
47 G G -1.2469 Soluble
48 Q G -1.8485 Soluble
49 G G -1.2843 Soluble
50 L G 0.0000 Buried
51 Q G -0.6614 Soluble
52 W G 0.0000 Buried
53 V G 0.0000 Buried
54 G G 0.0000 Buried
55 W G -0.1791 Soluble
56 I G 0.0000 Buried
57 N G -1.4618 Soluble
58 P G 0.0000 Buried
59 K G -2.3984 Soluble
62 T G -1.5141 Soluble
63 G G -1.6015 Soluble
64 Q G -1.8667 Soluble
65 P G -1.1879 Soluble
66 N G -1.4858 Soluble
67 N G -1.4394 Soluble
68 P G -1.7423 Soluble
69 R G -2.8917 Soluble
70 Q G -2.3547 Soluble
71 F G -1.6700 Soluble
72 Q G -2.1670 Soluble
74 G G -1.6219 Soluble
75 R G -1.6346 Soluble
76 V G -1.2031 Soluble
77 S G -1.0701 Soluble
78 L G 0.0000 Buried
79 T G -0.7586 Soluble
80 R G -1.4582 Soluble
81 H G -0.9803 Soluble
82 A G -0.4677 Soluble
83 S G -0.0048 Soluble
84 W G 0.5212 Aggregation-prone
85 D G -0.8442 Soluble
85A F G 0.4358 Aggregation-prone
85B D G -1.4377 Soluble
85C T G -0.9755 Soluble
85D Y G 0.0000 Buried
86 S G -0.6987 Soluble
87 F G 0.0000 Buried
88 Y G -0.6834 Soluble
89 M G 0.0000 Buried
90 D G -1.2736 Soluble
91 L G 0.0000 Buried
92 K G -2.4006 Soluble
93 A G -1.5768 Soluble
94 L G 0.0000 Buried
95 R G -3.0492 Soluble
96 S G -2.2178 Soluble
97 D G -2.4358 Soluble
98 D G 0.0000 Buried
99 T G -0.6638 Soluble
100 A G 0.0000 Buried
101 V G -0.1429 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 0.0000 Buried
108 R G -1.2688 Soluble
109 S G -1.0240 Soluble
110 D G -1.4964 Soluble
112 Y G -0.2310 Soluble
113 W G -0.2441 Soluble
114 D G 0.0000 Buried
115 F G 0.0000 Buried
116 D G -1.0346 Soluble
117 V G 0.0000 Buried
118 W G 0.0000 Buried
119 G G 0.0000 Buried
120 S G -0.7006 Soluble
121 G G -0.5421 Soluble
122 T G 0.0000 Buried
123 Q G -0.0631 Soluble
124 V G 0.0000 Buried
125 T G 0.1586 Aggregation-prone
126 V G -0.3427 Soluble
1 D K -2.0655 Soluble
2 I K -1.2053 Soluble
3 Q K -1.6420 Soluble
4 M K -0.9862 Soluble
5 T K -0.7206 Soluble
6 Q K -0.6903 Soluble
7 S K -0.5028 Soluble
8 P K -0.5985 Soluble
9 S K -0.7581 Soluble
10 S K -1.2454 Soluble
11 L K -0.6448 Soluble
12 S K -0.4892 Soluble
13 A K -0.0722 Soluble
14 S K 0.0590 Aggregation-prone
15 V K 0.2386 Aggregation-prone
16 G K -0.9334 Soluble
17 D K -1.2732 Soluble
18 T K -1.3565 Soluble
19 V K 0.0000 Buried
20 T K -0.3816 Soluble
21 I K 0.0000 Buried
22 T K -0.8247 Soluble
23 C K 0.0000 Buried
24 Q K -1.7962 Soluble
25 A K 0.0000 Buried
27 N K -1.6126 Soluble
28 G K -0.7536 Soluble
38 Y K 0.1828 Aggregation-prone
39 L K 0.0000 Buried
40 N K 0.0000 Buried
41 W K 0.0000 Buried
42 Y K 0.0000 Buried
43 Q K 0.0000 Buried
44 Q K 0.0000 Buried
45 R K -2.6707 Soluble
46 R K -3.0069 Soluble
47 G K -2.4237 Soluble
48 K K -2.9733 Soluble
49 A K -1.7228 Soluble
50 P K 0.0000 Buried
51 K K -1.8039 Soluble
52 L K 0.0000 Buried
53 L K 0.0000 Buried
54 I K 0.0000 Buried
55 Y K -0.4126 Soluble
56 D K -0.7514 Soluble
57 G K 0.0000 Buried
65 S K -1.9779 Soluble
66 K K -2.1481 Soluble
67 L K -1.1494 Soluble
68 E K 0.0000 Buried
69 R K -2.1844 Soluble
70 G K -1.2670 Soluble
71 V K -1.0045 Soluble
72 P K -0.6843 Soluble
74 S K -0.7273 Soluble
75 R K -1.2521 Soluble
76 F K 0.0000 Buried
77 S K -1.1915 Soluble
78 G K -1.9963 Soluble
79 R K -3.1875 Soluble
80 R K -3.0542 Soluble
83 W K -1.0830 Soluble
84 G K -1.2541 Soluble
85 Q K -2.1211 Soluble
86 E K -2.3579 Soluble
87 Y K 0.0000 Buried
88 N K -1.6484 Soluble
89 L K 0.0000 Buried
90 T K -0.9306 Soluble
91 I K 0.0000 Buried
92 N K -2.0751 Soluble
93 N K -2.0956 Soluble
94 L K 0.0000 Buried
95 Q K -1.2085 Soluble
96 P K -0.7198 Soluble
97 E K -1.6979 Soluble
98 D K 0.0000 Buried
99 I K -0.6341 Soluble
100 A K 0.0000 Buried
101 T K 0.0000 Buried
102 Y K 0.0000 Buried
103 F K 0.0000 Buried
104 C K 0.0000 Buried
105 Q K 0.0000 Buried
106 V K 0.0000 Buried
116 Y K 0.5720 Aggregation-prone
117 E K 0.2759 Aggregation-prone
118 F K 1.1132 Aggregation-prone
119 V K 0.5887 Aggregation-prone
120 V K 0.0000 Buried
121 P K -0.6098 Soluble
122 G K -1.1050 Soluble
123 T K 0.0000 Buried
124 R K -2.3054 Soluble
125 L K 0.0000 Buried
126 D K -1.2793 Soluble
127 L K 0.8789 Aggregation-prone

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
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 -0.6658 5.0907 CSV PDB
4.5 -0.7059 4.7819 CSV PDB
5.0 -0.7544 4.4062 CSV PDB
5.5 -0.8039 4.005 CSV PDB
6.0 -0.8461 3.6035 CSV PDB
6.5 -0.8751 3.2157 CSV PDB
7.0 -0.8918 2.9574 CSV PDB
7.5 -0.9011 2.8065 CSV PDB
8.0 -0.9057 2.7926 CSV PDB
8.5 -0.9046 2.7875 CSV PDB
9.0 -0.8956 2.7857 CSV PDB
Average A4D Score vs pH
Max A4D Score vs pH