Crovalimab / 5b71

A4DAB076_5b71_D_C | Source PDB: 5b71 | Chains: D, C | Done
100
Yes
10 Å
Yes
Avg A4D Score
-0.6935
Max Score
1.2944
Min Score
-3.5844
Total Score
-300.27
Score CDR
-0.3177
Score non-CDR
-0.7459

Calculation Parameters

Chain Sequence(s) VQLVESGGGLVQPGRSLRLSCAASGFTVHSSYYMAWVRQAPGKGLEWVGAIFTGSGAEYKAEWAKGRVTISKDTSKNQVVLTMTNMDPVDTATYYCASDAGYDYPTHAMHYWGQGTLVTVSSASTKGPSVFPLAPCSRTAALGCLVKDYFPEPVTVSWNSGALTSGVHTFPAVLQSSGLYSLSSVVTVPSSSLGTKTYTCNVDHKPSNTKVDKRVESKYDIQMTQSPSSLSASVGDRVTITCRASQGISSSLAWYQQKPGKAPKLLIYGASETESGVPSRFSGSGSGTDFTLTISSLQPEDFATYYCQNTKVGSSYGNTFGGGTKVEIKRTVAAPSVFIFPPSDEQLKSGTASVVCLLNNFYPREAKVQWKVDNALQSGNSQESVTEQDSKDSTYSLSSTLTLSKADYEKHKVYACEVTHQGLSSPVTKSFNR input.pdb
Selected Chain(s) D (Heavy), C (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 -3.5844
Maximum Score 1.2944
Average Score -0.6935
Total Score -300.2679

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

Index Residue Chain A4D Score Classification
2 V D 0.5506 Aggregation-prone
3 Q D -0.3826 Soluble
4 L D 0.0000 Buried
5 V D 0.9869 Aggregation-prone
6 E D 0.1572 Aggregation-prone
7 S D -0.4322 Soluble
8 G D -1.0293 Soluble
9 G D -0.5098 Soluble
11 G D 0.5022 Aggregation-prone
12 L D 1.0653 Aggregation-prone
13 V D 0.0000 Buried
14 Q D -2.0658 Soluble
15 P D -2.0740 Soluble
16 G D -2.5791 Soluble
17 R D -3.1148 Soluble
18 S D -2.3781 Soluble
19 L D 0.0000 Buried
20 R D -2.0821 Soluble
21 L D 0.0000 Buried
22 S D -0.5718 Soluble
23 C D 0.0000 Buried
24 A D -0.3979 Soluble
25 A D 0.0000 Buried
26 S D -0.2885 Soluble
27 G D 0.0177 Aggregation-prone
28 F D 0.3463 Aggregation-prone
29 T D 0.6018 Aggregation-prone
30 V D 1.2639 Aggregation-prone
31 H D -0.0578 Soluble
35 S D 0.0252 Aggregation-prone
36 S D 0.1384 Aggregation-prone
37 Y D 0.0000 Buried
38 Y D 0.0000 Buried
39 M D 0.0000 Buried
40 A D 0.0000 Buried
41 W D 0.0000 Buried
42 V D 0.0000 Buried
43 R D 0.0000 Buried
44 Q D -0.8717 Soluble
45 A D -0.6459 Soluble
46 P D -1.0616 Soluble
47 G D -1.5176 Soluble
48 K D -2.2787 Soluble
49 G D -1.4704 Soluble
50 L D 0.0000 Buried
51 E D -1.0102 Soluble
52 W D 0.0000 Buried
53 V D 0.0000 Buried
54 G D 0.0000 Buried
55 A D 0.0000 Buried
56 I D 0.0000 Buried
57 F D -0.2036 Soluble
58 T D -0.6839 Soluble
59 G D -0.7591 Soluble
62 S D -0.5650 Soluble
63 G D -0.6579 Soluble
64 A D -0.4770 Soluble
65 E D -0.8615 Soluble
66 Y D -0.6969 Soluble
67 K D -1.6952 Soluble
68 A D 0.0000 Buried
69 E D -2.7275 Soluble
70 W D -1.4682 Soluble
71 A D 0.0000 Buried
72 K D -2.6531 Soluble
74 G D -1.8726 Soluble
75 R D -1.4828 Soluble
76 V D 0.0000 Buried
77 T D -0.8708 Soluble
78 I D 0.0000 Buried
79 S D -0.6658 Soluble
80 K D -1.4387 Soluble
81 D D -1.7188 Soluble
82 T D -1.4266 Soluble
83 S D -1.5293 Soluble
84 K D -2.4791 Soluble
85 N D -1.9990 Soluble
86 Q D -1.4178 Soluble
87 V D 0.0000 Buried
88 V D -0.6661 Soluble
89 L D 0.0000 Buried
90 T D -0.8653 Soluble
91 M D 0.0000 Buried
92 T D -1.8686 Soluble
93 N D -2.6516 Soluble
94 M D 0.0000 Buried
95 D D -1.5011 Soluble
96 P D -0.1731 Soluble
97 V D 1.2944 Aggregation-prone
98 D D 0.0000 Buried
99 T D 0.5162 Aggregation-prone
100 A D 0.0000 Buried
101 T D 0.0217 Aggregation-prone
102 Y D 0.0000 Buried
103 Y D 0.0000 Buried
104 C D 0.0000 Buried
105 A D 0.0000 Buried
106 S D 0.0000 Buried
107 D D 0.0000 Buried
108 A D 0.0000 Buried
109 G D 0.0000 Buried
110 Y D 0.3293 Aggregation-prone
111 D D -1.0671 Soluble
111A Y D -0.4184 Soluble
112A P D -0.2785 Soluble
112 T D -0.3492 Soluble
113 H D -0.2722 Soluble
114 A D 0.0000 Buried
115 M D 0.0000 Buried
116 H D -0.1113 Soluble
117 Y D 0.0991 Aggregation-prone
118 W D -0.1557 Soluble
119 G D 0.0000 Buried
120 Q D -1.3728 Soluble
121 G D -0.6092 Soluble
122 T D -0.0063 Soluble
123 L D 0.7534 Aggregation-prone
124 V D 0.0000 Buried
125 T D 0.0000 Buried
126 V D 0.0000 Buried
127 S D -0.3784 Soluble
128 S D -0.6968 Soluble
129 A D -0.4366 Soluble
130 S D -0.6049 Soluble
131 T D -0.8445 Soluble
132 K D -1.5393 Soluble
133 G D -1.5885 Soluble
134 P D 0.0000 Buried
135 S D -0.5270 Soluble
136 V D 0.0000 Buried
137 F D 0.0000 Buried
138 P D -1.3137 Soluble
139 L D 0.0000 Buried
140 A D -1.0149 Soluble
141 P D -0.8844 Soluble
142 C D -0.9987 Soluble
143 S D -1.1639 Soluble
144 R D -2.3142 Soluble
145 T D -0.4879 Soluble
146 A D -0.5219 Soluble
147 A D 0.0000 Buried
148 L D 0.0000 Buried
149 G D 0.0000 Buried
150 C D 0.0000 Buried
151 L D 0.0000 Buried
152 V D 0.0000 Buried
153 K D 0.0000 Buried
154 D D -0.5239 Soluble
155 Y D 0.0000 Buried
156 F D 0.0000 Buried
157 P D 0.0000 Buried
158 E D -0.6181 Soluble
159 P D -0.8266 Soluble
160 V D -0.7589 Soluble
161 T D -0.6699 Soluble
162 V D -0.2765 Soluble
163 S D -0.4955 Soluble
164 W D 0.0000 Buried
165 N D -0.9664 Soluble
166 S D -0.7114 Soluble
167 G D -0.4617 Soluble
168 A D -0.1932 Soluble
169 L D -0.0500 Soluble
170 T D -0.1330 Soluble
171 S D -0.1961 Soluble
172 G D -0.3919 Soluble
173 V D 0.1635 Aggregation-prone
174 H D -0.1461 Soluble
175 T D 0.0429 Aggregation-prone
176 F D 0.0000 Buried
177 P D -0.3865 Soluble
178 A D 0.1899 Aggregation-prone
179 V D 0.5827 Aggregation-prone
180 L D 1.2586 Aggregation-prone
181 Q D 0.3680 Aggregation-prone
182 S D -0.0431 Soluble
183 S D -0.1976 Soluble
184 G D -0.0076 Soluble
185 L D -0.0131 Soluble
186 Y D 0.0000 Buried
187 S D 0.0000 Buried
188 L D 0.0000 Buried
189 S D 0.0000 Buried
190 S D 0.0000 Buried
191 V D 0.0000 Buried
192 V D 0.0000 Buried
193 T D -0.1440 Soluble
194 V D 0.0000 Buried
195 P D -0.4267 Soluble
196 S D -0.8300 Soluble
197 S D -0.8650 Soluble
198 S D -0.8444 Soluble
199 L D -1.3766 Soluble
200 G D -1.3270 Soluble
201 T D -1.0159 Soluble
202 K D -1.6557 Soluble
203 T D -1.5768 Soluble
204 Y D 0.0000 Buried
205 T D -1.8673 Soluble
206 C D 0.0000 Buried
207 N D -1.7726 Soluble
208 V D 0.0000 Buried
209 D D -2.2127 Soluble
210 H D 0.0000 Buried
211 K D -2.7933 Soluble
212 P D -1.7139 Soluble
213 S D -1.9338 Soluble
214 N D -2.6967 Soluble
215 T D -2.1845 Soluble
216 K D -2.8303 Soluble
217 V D -1.7570 Soluble
218 D D -2.8833 Soluble
219 K D -2.4208 Soluble
220 R D -2.9720 Soluble
221 V D 0.0000 Buried
222 E D -2.8905 Soluble
223 S D 0.0000 Buried
224 K D -1.9615 Soluble
225 Y D -0.0536 Soluble
1 D C -2.2278 Soluble
2 I C 0.0000 Buried
3 Q C -2.0777 Soluble
4 M C 0.0000 Buried
5 T C -1.4128 Soluble
6 Q C -1.0062 Soluble
7 S C -0.7101 Soluble
8 P C -0.4982 Soluble
9 S C -0.5945 Soluble
10 S C -0.4212 Soluble
11 L C -0.3021 Soluble
12 S C -0.7379 Soluble
13 A C 0.0000 Buried
14 S C -0.4440 Soluble
15 V C 0.4924 Aggregation-prone
16 G C -0.5406 Soluble
17 D C -1.5953 Soluble
18 R C -2.2669 Soluble
19 V C 0.0000 Buried
20 T C -0.6278 Soluble
21 I C 0.0000 Buried
22 T C -0.9616 Soluble
23 C C 0.0000 Buried
24 R C -2.8395 Soluble
25 A C 0.0000 Buried
26 S C -1.9638 Soluble
27 Q C -2.0345 Soluble
28 G C -1.6213 Soluble
29 I C 0.0000 Buried
36 S C -0.9841 Soluble
37 S C -0.8053 Soluble
38 S C -0.5564 Soluble
39 L C 0.0000 Buried
40 A C 0.0000 Buried
41 W C 0.0000 Buried
42 Y C 0.0000 Buried
43 Q C 0.0000 Buried
44 Q C 0.0000 Buried
45 K C -2.0523 Soluble
46 P C -1.6722 Soluble
47 G C -1.7256 Soluble
48 K C -2.6688 Soluble
49 A C -1.7429 Soluble
50 P C 0.0000 Buried
51 K C -1.5881 Soluble
52 L C -0.5925 Soluble
53 L C 0.0000 Buried
54 I C 0.0000 Buried
55 Y C 0.0000 Buried
56 G C -0.9965 Soluble
57 A C 0.0000 Buried
65 S C -1.3451 Soluble
66 E C -2.2360 Soluble
67 T C -1.4965 Soluble
68 E C -1.3508 Soluble
69 S C -1.0026 Soluble
70 G C -0.7339 Soluble
71 V C -0.5505 Soluble
72 P C -0.4411 Soluble
74 S C -0.4751 Soluble
75 R C -0.7407 Soluble
76 F C 0.0000 Buried
77 S C -0.7020 Soluble
78 G C -0.7633 Soluble
79 S C -0.9850 Soluble
80 G C -1.2260 Soluble
83 S C -1.0781 Soluble
84 G C -1.4462 Soluble
85 T C -2.0560 Soluble
86 D C -2.6875 Soluble
87 F C 0.0000 Buried
88 T C -0.8720 Soluble
89 L C 0.0000 Buried
90 T C -0.6201 Soluble
91 I C 0.0000 Buried
92 S C -1.3131 Soluble
93 S C -1.0437 Soluble
94 L C 0.0000 Buried
95 Q C -0.9240 Soluble
96 P C -0.8907 Soluble
97 E C -2.0108 Soluble
98 D C 0.0000 Buried
99 F C 0.0000 Buried
100 A C 0.0000 Buried
101 T C -0.6126 Soluble
102 Y C 0.0000 Buried
103 Y C 0.0000 Buried
104 C C 0.0000 Buried
105 Q C 0.0000 Buried
106 N C 0.0000 Buried
107 T C 0.0000 Buried
108 K C -0.6811 Soluble
109 V C -0.0564 Soluble
110 G C -0.3122 Soluble
112 S C -0.8012 Soluble
113 S C -0.8746 Soluble
114 Y C -1.0899 Soluble
115 G C 0.0000 Buried
116 N C 0.0000 Buried
117 T C -0.7370 Soluble
118 F C 0.0000 Buried
119 G C 0.0000 Buried
120 G C -1.1818 Soluble
121 G C -0.8227 Soluble
122 T C 0.0000 Buried
123 K C -0.7198 Soluble
124 V C 0.0000 Buried
125 E C 0.0000 Buried
126 I C -0.4231 Soluble
127 K C -1.3765 Soluble
128 R C -1.0775 Soluble
129 T C -0.0727 Soluble
130 V C 0.7015 Aggregation-prone
131 A C 0.2592 Aggregation-prone
132 A C -0.0410 Soluble
133 P C 0.0000 Buried
134 S C -0.1457 Soluble
135 V C 0.0000 Buried
136 F C -0.0211 Soluble
137 I C 0.0000 Buried
138 F C 0.0000 Buried
139 P C 0.0000 Buried
140 P C 0.0000 Buried
141 S C -1.8943 Soluble
142 D C -3.2266 Soluble
143 E C -3.2401 Soluble
144 Q C 0.0000 Buried
145 L C -2.2501 Soluble
146 K C -2.8929 Soluble
147 S C -1.7923 Soluble
148 G C -1.2570 Soluble
149 T C -1.0662 Soluble
150 A C 0.0000 Buried
151 S C 0.0000 Buried
152 V C 0.0000 Buried
153 V C 0.0000 Buried
154 C C 0.0000 Buried
155 L C 0.0000 Buried
156 L C 0.0000 Buried
157 N C 0.0000 Buried
158 N C -0.7119 Soluble
159 F C 0.0000 Buried
160 Y C 0.0000 Buried
161 P C -1.1738 Soluble
162 R C -1.9743 Soluble
163 E C -2.6915 Soluble
164 A C -2.0482 Soluble
165 K C -2.2869 Soluble
166 V C -1.0063 Soluble
167 Q C -0.4952 Soluble
168 W C 0.0000 Buried
169 K C -0.5641 Soluble
170 V C 0.0000 Buried
171 D C -1.9199 Soluble
172 N C -1.4310 Soluble
173 A C -0.2957 Soluble
174 L C 0.6786 Aggregation-prone
175 Q C -0.3220 Soluble
176 S C -0.7447 Soluble
177 G C -1.2980 Soluble
178 N C -1.6630 Soluble
179 S C -1.3306 Soluble
180 Q C -1.1189 Soluble
181 E C -1.4039 Soluble
182 S C -0.4399 Soluble
183 V C -0.2189 Soluble
184 T C -0.8821 Soluble
185 E C -2.0556 Soluble
186 Q C -1.6561 Soluble
187 D C -1.9402 Soluble
188 S C -1.6777 Soluble
189 K C -2.2845 Soluble
190 D C -1.6700 Soluble
191 S C -1.6259 Soluble
192 T C 0.0000 Buried
193 Y C 0.0000 Buried
194 S C 0.0000 Buried
195 L C 0.0000 Buried
196 S C 0.0000 Buried
197 S C 0.0000 Buried
198 T C 0.0000 Buried
199 L C 0.0000 Buried
200 T C -0.6609 Soluble
201 L C -0.8748 Soluble
202 S C -1.1169 Soluble
203 K C -2.0905 Soluble
204 A C -1.8832 Soluble
205 D C -2.6838 Soluble
206 Y C 0.0000 Buried
207 E C -3.3937 Soluble
208 K C -3.5844 Soluble
209 H C -3.3129 Soluble
210 K C -3.5170 Soluble
211 V C -2.0071 Soluble
212 Y C 0.0000 Buried
213 A C 0.0000 Buried
214 C C 0.0000 Buried
215 E C -0.6278 Soluble
216 V C 0.0000 Buried
217 T C -1.2125 Soluble
218 H C 0.0000 Buried
219 Q C -1.5791 Soluble
220 G C -0.3537 Soluble
221 L C -0.1631 Soluble
222 S C -0.4327 Soluble
223 S C -0.4087 Soluble
224 P C -0.5506 Soluble
225 V C -0.0978 Soluble
226 T C -0.5400 Soluble
227 K C -0.8839 Soluble
228 S C -0.9919 Soluble
229 F C 0.0000 Buried
230 N C -2.6396 Soluble
231 R C -3.2865 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
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 -0.7823 2.3627 CSV PDB
4.5 -0.8243 2.2879 CSV PDB
5.0 -0.8733 2.2059 CSV PDB
5.5 -0.9196 2.1214 CSV PDB
6.0 -0.952 2.0361 CSV PDB
6.5 -0.9608 1.9508 CSV PDB
7.0 -0.9457 1.8659 CSV PDB
7.5 -0.9154 1.8319 CSV PDB
8.0 -0.8772 1.8244 CSV PDB
8.5 -0.8329 1.8219 CSV PDB
9.0 -0.7825 1.84 CSV PDB
Average A4D Score vs pH
Max A4D Score vs pH