Atezolizumab / 5x8l

A4DAB026_5x8l_S_N | Source PDB: 5x8l | Chains: S, N | Done
100
Yes
10 Å
Yes
Avg A4D Score
-0.6674
Max Score
2.0068
Min Score
-3.6976
Total Score
-276.96
Score CDR
-0.2012
Score non-CDR
-0.7241

Calculation Parameters

Chain Sequence(s) EVQLVESGGGLVQPGGSLRLSCAASGFTFSDSWIHWVRQAPGKGLEWVAWISPYGGSTYYADSVKGRFTISADTSKNTAYLQMNSLRAEDTAVYYCARRHWPGGFDYWGQGTLVTVSSASTKGPSVFPTSGGTAALGCLVKDYFPEPVTVSWNSGALTSGVHTFPAVLQSSGLYSLSSVVTVPSSSLGTQTYICNVNHKPSNTKVDKKVEPDIQMTQSPSSLSASVGDRVTITCRASQDVSTAVAWYQQKPGKAPKLLIYSASFLYSGVPSRFSGSGSGTDFTLTISSLQPEDFATYYCQQYLYHPATFGQGTKVEIKRTVAAPSVFIFPPSDEQLKSGTASVVCLLNNFYPREAKVQWNSQESVTEQDSKDSTYSLSSTLTLSKADYEKHKVYACEVTHQGLSSPVTKSFNRGE input.pdb
Selected Chain(s) S (Heavy), N (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 -3.6976
Maximum Score 2.0068
Average Score -0.6674
Total Score -276.961

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

Index Residue Chain A4D Score Classification
1 E S -2.0103 Soluble
2 V S -1.0317 Soluble
3 Q S -1.4067 Soluble
4 L S 0.0000 Buried
5 V S 0.1212 Aggregation-prone
6 E S 0.0000 Buried
7 S S -0.5358 Soluble
8 G S -0.8000 Soluble
9 G S -0.4229 Soluble
11 G S -0.2900 Soluble
12 L S -0.1818 Soluble
13 V S -0.7657 Soluble
14 Q S -1.7278 Soluble
15 P S -1.8932 Soluble
16 G S -1.5203 Soluble
17 G S -1.1994 Soluble
18 S S -1.1147 Soluble
19 L S -0.8347 Soluble
20 R S -1.5851 Soluble
21 L S 0.0000 Buried
22 S S -0.3661 Soluble
23 C S 0.0000 Buried
24 A S -0.3622 Soluble
25 A S 0.0000 Buried
26 S S -1.0979 Soluble
27 G S -1.1683 Soluble
28 F S -0.7128 Soluble
29 T S -0.7528 Soluble
30 F S 0.0000 Buried
35 S S -0.7027 Soluble
36 D S -1.4536 Soluble
37 S S 0.0000 Buried
38 W S 0.0437 Aggregation-prone
39 I S 0.0000 Buried
40 H S 0.0000 Buried
41 W S 0.0000 Buried
42 V S 0.0000 Buried
43 R S 0.0000 Buried
44 Q S -0.8887 Soluble
45 A S -1.2511 Soluble
46 P S -0.8719 Soluble
47 G S -1.5645 Soluble
48 K S -2.4456 Soluble
49 G S -1.6784 Soluble
50 L S 0.0000 Buried
51 E S -1.4465 Soluble
52 W S 0.0000 Buried
53 V S 0.0000 Buried
54 A S 0.0000 Buried
55 W S 0.4270 Aggregation-prone
56 I S 0.0000 Buried
57 S S 0.0142 Aggregation-prone
58 P S 0.0000 Buried
59 Y S 0.4514 Aggregation-prone
62 G S -0.0413 Soluble
63 G S -0.2427 Soluble
64 S S 0.0099 Aggregation-prone
65 T S 0.2746 Aggregation-prone
66 Y S 0.5492 Aggregation-prone
67 Y S -0.4278 Soluble
68 A S -1.3875 Soluble
69 D S -2.3094 Soluble
70 S S -1.7392 Soluble
71 V S 0.0000 Buried
72 K S -2.3519 Soluble
74 G S -1.6176 Soluble
75 R S 0.0000 Buried
76 F S 0.0000 Buried
77 T S -0.5800 Soluble
78 I S 0.0000 Buried
79 S S -0.2354 Soluble
80 A S -0.5968 Soluble
81 D S -1.1894 Soluble
82 T S -1.0268 Soluble
83 S S -1.3992 Soluble
84 K S -2.2305 Soluble
85 N S -1.5912 Soluble
86 T S 0.0000 Buried
87 A S 0.0000 Buried
88 Y S -0.3717 Soluble
89 L S 0.0000 Buried
90 Q S -0.8382 Soluble
91 M S 0.0000 Buried
92 N S -1.2911 Soluble
93 S S -1.2755 Soluble
94 L S 0.0000 Buried
95 R S -2.5902 Soluble
96 A S -1.8662 Soluble
97 E S -2.3683 Soluble
98 D S 0.0000 Buried
99 T S -0.6864 Soluble
100 A S 0.0000 Buried
101 V S 0.2710 Aggregation-prone
102 Y S 0.0000 Buried
103 Y S 0.0000 Buried
104 C S 0.0000 Buried
105 A S 0.0000 Buried
106 R S -0.1775 Soluble
107 R S 0.0463 Aggregation-prone
108 H S 0.3483 Aggregation-prone
109 W S 0.9589 Aggregation-prone
110 P S 0.2997 Aggregation-prone
113 G S 0.0000 Buried
114 G S 0.0000 Buried
115 F S 0.0000 Buried
116 D S 0.0000 Buried
117 Y S -0.1859 Soluble
118 W S -0.5228 Soluble
119 G S 0.0000 Buried
120 Q S -1.4547 Soluble
121 G S -0.6304 Soluble
122 T S -0.0289 Soluble
123 L S 0.3489 Aggregation-prone
124 V S 0.0000 Buried
125 T S 0.0000 Buried
126 V S 0.0000 Buried
127 S S -1.1152 Soluble
128 S S -0.8597 Soluble
129 A S -0.5803 Soluble
130 S S -0.7002 Soluble
131 T S -1.0170 Soluble
132 K S -1.5785 Soluble
133 G S -1.5079 Soluble
134 P S 0.0000 Buried
135 S S -0.2770 Soluble
136 V S 0.0000 Buried
137 F S -0.2781 Soluble
138 P S -1.0516 Soluble
139 T S -0.4870 Soluble
140 S S -0.6191 Soluble
141 G S -0.8594 Soluble
142 G S -0.8829 Soluble
143 T S -0.6377 Soluble
144 A S -0.1948 Soluble
145 A S 0.1341 Aggregation-prone
146 L S -0.0950 Soluble
147 G S -0.2043 Soluble
148 C S 0.0000 Buried
149 L S 0.0000 Buried
150 V S 0.0000 Buried
151 K S 0.0000 Buried
152 D S -0.4778 Soluble
153 Y S 0.0000 Buried
154 F S 0.0000 Buried
155 P S 0.0000 Buried
156 E S -0.8190 Soluble
157 P S -0.7042 Soluble
158 V S -0.5992 Soluble
159 T S -0.4284 Soluble
160 V S -0.0877 Soluble
161 S S -0.3742 Soluble
162 W S 0.0000 Buried
163 N S -0.7012 Soluble
164 S S -0.6330 Soluble
165 G S -0.5570 Soluble
166 A S -0.2004 Soluble
167 L S -0.0075 Soluble
168 T S -0.1470 Soluble
169 S S -0.4688 Soluble
170 G S -0.2055 Soluble
171 V S 0.2555 Aggregation-prone
172 H S 0.0000 Buried
173 T S 0.0903 Aggregation-prone
174 F S 0.0000 Buried
175 P S -0.0838 Soluble
176 A S 0.3116 Aggregation-prone
177 V S 0.7745 Aggregation-prone
178 L S 1.2081 Aggregation-prone
179 Q S 0.2549 Aggregation-prone
180 S S -0.2086 Soluble
181 S S -0.2228 Soluble
182 G S 0.0029 Aggregation-prone
183 L S 0.0560 Aggregation-prone
184 Y S 0.3212 Aggregation-prone
185 S S 0.0000 Buried
186 L S 0.0000 Buried
187 S S 0.0000 Buried
188 S S 0.0000 Buried
189 V S 0.0000 Buried
190 V S 0.0000 Buried
191 T S -0.0325 Soluble
192 V S 0.0000 Buried
193 P S -0.3384 Soluble
194 S S -0.2393 Soluble
195 S S -0.2410 Soluble
196 S S -0.0506 Soluble
197 L S 0.1224 Aggregation-prone
198 G S -0.5056 Soluble
199 T S -0.3340 Soluble
200 Q S -0.7015 Soluble
201 T S -0.6270 Soluble
202 Y S -0.7537 Soluble
203 I S -1.2564 Soluble
204 C S 0.0000 Buried
205 N S -1.4923 Soluble
206 V S 0.0000 Buried
207 N S -1.9503 Soluble
208 H S 0.0000 Buried
209 K S -2.8890 Soluble
210 P S -1.6664 Soluble
211 S S -2.0340 Soluble
212 N S -2.7579 Soluble
213 T S -2.1500 Soluble
214 K S -2.7276 Soluble
215 V S -1.8387 Soluble
216 D S -2.6935 Soluble
217 K S -2.0926 Soluble
218 K S -2.3609 Soluble
219 V S 0.0000 Buried
220 E S -2.1675 Soluble
221 P S -1.2610 Soluble
1 D N -2.1197 Soluble
2 I N -1.5955 Soluble
3 Q N -2.1473 Soluble
4 M N 0.0000 Buried
5 T N -1.3509 Soluble
6 Q N 0.0000 Buried
7 S N -0.8101 Soluble
8 P N -0.4512 Soluble
9 S N -0.6761 Soluble
10 S N -0.5639 Soluble
11 L N -0.4391 Soluble
12 S N -1.0585 Soluble
13 A N -1.2156 Soluble
14 S N -1.1818 Soluble
15 V N -0.3637 Soluble
16 G N -0.8986 Soluble
17 D N -1.7244 Soluble
18 R N -2.3066 Soluble
19 V N 0.0000 Buried
20 T N -0.6458 Soluble
21 I N 0.0000 Buried
22 T N -0.7923 Soluble
23 C N 0.0000 Buried
24 R N -2.8945 Soluble
25 A N 0.0000 Buried
26 S N -2.2137 Soluble
27 Q N -2.8651 Soluble
28 D N -2.6446 Soluble
29 V N 0.0000 Buried
36 S N -1.0080 Soluble
37 T N -0.5344 Soluble
38 A N 0.0657 Aggregation-prone
39 V N 0.0000 Buried
40 A N 0.0000 Buried
41 W N 0.0000 Buried
42 Y N 0.0000 Buried
43 Q N 0.0000 Buried
44 Q N -1.4079 Soluble
45 K N -1.9018 Soluble
46 P N -1.5847 Soluble
47 G N -1.7341 Soluble
48 K N -2.6510 Soluble
49 A N -1.6759 Soluble
50 P N 0.0000 Buried
51 K N -1.3515 Soluble
52 L N 0.0000 Buried
53 L N 0.0000 Buried
54 I N 0.0000 Buried
55 Y N 0.8747 Aggregation-prone
56 S N 0.5085 Aggregation-prone
57 A N 0.0000 Buried
65 S N 0.6498 Aggregation-prone
66 F N 2.0068 Aggregation-prone
67 L N 1.1477 Aggregation-prone
68 Y N 0.4460 Aggregation-prone
69 S N -0.0454 Soluble
70 G N -0.5179 Soluble
71 V N 0.0000 Buried
72 P N -0.3826 Soluble
74 S N -0.4459 Soluble
75 R N -0.7282 Soluble
76 F N 0.0000 Buried
77 S N 0.0409 Aggregation-prone
78 G N 0.0892 Aggregation-prone
79 S N -0.3862 Soluble
80 G N -1.0194 Soluble
83 S N -1.2593 Soluble
84 G N -1.7896 Soluble
85 T N -2.2280 Soluble
86 D N -2.1985 Soluble
87 F N 0.0000 Buried
88 T N -0.7294 Soluble
89 L N 0.0000 Buried
90 T N -0.5988 Soluble
91 I N 0.0000 Buried
92 S N -1.2637 Soluble
93 S N -1.2020 Soluble
94 L N 0.0000 Buried
95 Q N -1.0772 Soluble
96 P N -1.0768 Soluble
97 E N -1.9797 Soluble
98 D N 0.0000 Buried
99 F N -0.6383 Soluble
100 A N 0.0000 Buried
101 T N -0.6999 Soluble
102 Y N 0.0000 Buried
103 Y N 0.0000 Buried
104 C N 0.0000 Buried
105 Q N 0.0000 Buried
106 Q N 0.0000 Buried
107 Y N 0.6634 Aggregation-prone
108 L N 0.9683 Aggregation-prone
109 Y N 0.6330 Aggregation-prone
114 H N -0.4921 Soluble
115 P N -0.8797 Soluble
116 A N -0.3596 Soluble
117 T N -0.7683 Soluble
118 F N -0.5089 Soluble
119 G N 0.0000 Buried
120 Q N -1.5986 Soluble
121 G N 0.0000 Buried
122 T N 0.0000 Buried
123 K N -0.9491 Soluble
124 V N 0.0000 Buried
125 E N -1.2268 Soluble
126 I N 0.0000 Buried
127 K N -2.2527 Soluble
128 R N -2.1903 Soluble
129 T N -0.3590 Soluble
130 V N 0.9258 Aggregation-prone
131 A N 0.3465 Aggregation-prone
132 A N 0.1213 Aggregation-prone
133 P N 0.0000 Buried
134 S N -0.1759 Soluble
135 V N 0.0000 Buried
136 F N 0.0634 Aggregation-prone
137 I N 0.3139 Aggregation-prone
138 F N 0.5245 Aggregation-prone
139 P N -0.8341 Soluble
140 P N -0.4690 Soluble
141 S N -1.2066 Soluble
142 D N -2.4396 Soluble
143 E N -1.5754 Soluble
144 Q N 0.0000 Buried
145 L N -1.0753 Soluble
146 K N -1.8465 Soluble
147 S N -1.0135 Soluble
148 G N -0.6979 Soluble
149 T N -0.5718 Soluble
150 A N 0.0000 Buried
151 S N 0.0000 Buried
152 V N 0.0000 Buried
153 V N 0.0000 Buried
154 C N 0.0000 Buried
155 L N 0.0000 Buried
156 L N 0.0000 Buried
157 N N 0.0000 Buried
158 N N -0.7539 Soluble
159 F N 0.0000 Buried
160 Y N 0.0000 Buried
161 P N -1.9405 Soluble
162 R N -3.1164 Soluble
163 E N -3.2270 Soluble
164 A N -2.1898 Soluble
165 K N -2.4186 Soluble
166 V N -1.1240 Soluble
167 Q N -1.3092 Soluble
168 W N -0.3701 Soluble
169 N N -1.3586 Soluble
170 S N -1.1860 Soluble
171 Q N -0.9127 Soluble
172 E N -0.9281 Soluble
173 S N -0.3674 Soluble
174 V N -0.4030 Soluble
175 T N -1.0645 Soluble
176 E N -2.2150 Soluble
177 Q N -2.0819 Soluble
178 D N -2.0012 Soluble
179 S N -1.8141 Soluble
180 K N -2.3504 Soluble
181 D N -2.1003 Soluble
182 S N -2.1634 Soluble
183 T N -1.7901 Soluble
184 Y N 0.0000 Buried
185 S N 0.0000 Buried
186 L N 0.0000 Buried
187 S N 0.0000 Buried
188 S N 0.0000 Buried
189 T N -0.3886 Soluble
190 L N -0.2973 Soluble
191 T N -0.4286 Soluble
192 L N -0.5874 Soluble
193 S N -0.8877 Soluble
194 K N -1.8679 Soluble
195 A N -1.8796 Soluble
196 D N -2.7577 Soluble
197 Y N -2.3030 Soluble
198 E N -3.4690 Soluble
199 K N -3.6976 Soluble
200 H N -3.0665 Soluble
201 K N -2.5098 Soluble
202 V N -0.8933 Soluble
203 Y N 0.0217 Aggregation-prone
204 A N -0.3100 Soluble
205 C N 0.0000 Buried
206 E N -0.7451 Soluble
207 V N 0.0000 Buried
208 T N -0.7765 Soluble
209 H N -1.2470 Soluble
210 Q N -1.4195 Soluble
211 G N -0.1564 Soluble
212 L N 0.0062 Aggregation-prone
213 S N -0.4148 Soluble
214 S N -0.3044 Soluble
215 P N -0.3416 Soluble
216 V N 0.2997 Aggregation-prone
217 T N -0.4029 Soluble
218 K N -0.9993 Soluble
219 S N -0.8516 Soluble
220 F N -0.8788 Soluble
221 N N -2.3642 Soluble
222 R N -3.1401 Soluble
223 G N -2.7603 Soluble
224 E N -3.1041 Soluble

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
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A4D Score Threshold
Highlight residues > threshold in the sequence panel
CDR Regions
HCDR1
HCDR2
HCDR3
LCDR1
LCDR2
LCDR3
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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 -0.6196 4.0247 CSV PDB
4.5 -0.664 4.034 CSV PDB
5.0 -0.714 4.0475 CSV PDB
5.5 -0.7596 4.06 CSV PDB
6.0 -0.7903 4.0675 CSV PDB
6.5 -0.7982 4.0706 CSV PDB
7.0 -0.7852 4.0717 CSV PDB
7.5 -0.7597 4.0721 CSV PDB
8.0 -0.728 4.0722 CSV PDB
8.5 -0.691 4.0722 CSV PDB
9.0 -0.6476 4.0722 CSV PDB
Average A4D Score vs pH
Max A4D Score vs pH