Motavizumab / 5k8a

A4DAB172_5k8a_F_E | Source PDB: 5k8a | Chains: F, E | Done
100
Yes
10 Å
Yes
Avg A4D Score
-0.7028
Max Score
2.3981
Min Score
-3.3374
Total Score
-305.73
Score CDR
-0.2752
Score non-CDR
-0.7534

Calculation Parameters

Chain Sequence(s) VTLRESGPALVKPTQTLTLTCTFSGFSLSTAGMSVGWIRQPPGKALEWLADIWWDDKKHYNPSLKDRLTISKDTSKNQVVLKVTNMDPADTATYYCARDMIFNFYFDVWGQGTTVTVSSASTKGPSVFPLAPSSKSTSGGTAALGCLVKDYFPEPVTVSWNSGALTSGVHTFPAVLQSSGLYSLSSVVTVPSSSLGTQTYICNVNHKPSNTKVDKRVEPKSCDIQMTQSPSTLSASVGDRVTITCSASSRVGYMHWYQQKPGKAPKLLIYDTSKLASGVPSRFSGSGSGTEFTLTISSLQPDDFATYYCFQGSGYPFTFGGGTKVEIKRTVAAPSVFIFPPSDEQLKSGTASVVCLLNNFYPREAKVQWKVDNALQSGNSQESVTEQDSKDSTYSLSSTLTLSKADYEKHKVYACEVTHQGLSSPVTKSFNRGEC input.pdb
Selected Chain(s) F (Heavy), E (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 -3.3374
Maximum Score 2.3981
Average Score -0.7028
Total Score -305.7273

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

Index Residue Chain A4D Score Classification
2 V F 1.3665 Aggregation-prone
3 T F 0.0966 Aggregation-prone
4 L F 0.0000 Buried
5 R F -2.2334 Soluble
6 E F 0.0000 Buried
7 S F -0.6749 Soluble
8 G F -0.3172 Soluble
9 P F -0.2021 Soluble
11 A F -0.3591 Soluble
12 L F -0.2089 Soluble
13 V F 0.0000 Buried
14 K F -1.9408 Soluble
15 P F -1.7384 Soluble
16 T F -1.7664 Soluble
17 Q F -1.9933 Soluble
18 T F -1.5083 Soluble
19 L F 0.0000 Buried
20 T F -0.5989 Soluble
21 L F 0.0000 Buried
22 T F -0.5438 Soluble
23 C F 0.0000 Buried
24 T F -1.2669 Soluble
25 F F 0.0000 Buried
26 S F -0.3892 Soluble
27 G F 0.1945 Aggregation-prone
28 F F 0.1492 Aggregation-prone
29 S F -0.2889 Soluble
30 L F 0.0000 Buried
31 S F -0.6073 Soluble
34 T F -0.1359 Soluble
35 A F 0.0414 Aggregation-prone
36 G F 0.0000 Buried
37 M F 0.0000 Buried
38 S F 0.0000 Buried
39 V F 0.0000 Buried
40 G F 0.0000 Buried
41 W F 0.0000 Buried
42 I F 0.0000 Buried
43 R F -0.7532 Soluble
44 Q F -1.0638 Soluble
45 P F -1.0806 Soluble
46 P F -1.1286 Soluble
47 G F -1.5112 Soluble
48 K F -2.2541 Soluble
49 A F -1.3812 Soluble
50 L F 0.0000 Buried
51 E F -1.2037 Soluble
52 W F 0.0000 Buried
53 L F 0.0000 Buried
54 A F 0.0000 Buried
55 D F 0.0000 Buried
56 I F 0.0000 Buried
57 W F 0.0000 Buried
58 W F -1.2134 Soluble
59 D F -2.3649 Soluble
63 D F -3.2365 Soluble
64 K F -3.2107 Soluble
65 K F -2.2127 Soluble
66 H F -1.1759 Soluble
67 Y F -0.7468 Soluble
68 N F 0.0000 Buried
69 P F -1.1748 Soluble
70 S F -0.9466 Soluble
71 L F -1.3442 Soluble
72 K F -2.6067 Soluble
74 D F -2.7182 Soluble
75 R F -2.1355 Soluble
76 L F 0.0000 Buried
77 T F -1.1025 Soluble
78 I F 0.0000 Buried
79 S F -1.0480 Soluble
80 K F -1.2433 Soluble
81 D F -1.5811 Soluble
82 T F -1.3495 Soluble
83 S F -1.4863 Soluble
84 K F -2.3792 Soluble
85 N F -1.7732 Soluble
86 Q F -1.5991 Soluble
87 V F 0.0000 Buried
88 V F -0.2122 Soluble
89 L F 0.0000 Buried
90 K F -1.1136 Soluble
91 V F 0.0000 Buried
92 T F -1.6694 Soluble
93 N F -2.1243 Soluble
94 M F 0.0000 Buried
95 D F -1.8709 Soluble
96 P F -0.9045 Soluble
97 A F -0.4118 Soluble
98 D F 0.0000 Buried
99 T F -0.3449 Soluble
100 A F 0.0000 Buried
101 T F -0.5611 Soluble
102 Y F 0.0000 Buried
103 Y F 0.0000 Buried
104 C F 0.0000 Buried
105 A F 0.0000 Buried
106 R F 0.1234 Aggregation-prone
107 D F 0.0000 Buried
108 M F 1.1487 Aggregation-prone
109 I F 2.0166 Aggregation-prone
110 F F 2.3981 Aggregation-prone
112 N F 1.0338 Aggregation-prone
113 F F 0.9825 Aggregation-prone
114 Y F 0.0000 Buried
115 F F 0.0000 Buried
116 D F -0.3897 Soluble
117 V F 0.0960 Aggregation-prone
118 W F -0.5082 Soluble
119 G F 0.0000 Buried
120 Q F -2.0104 Soluble
121 G F 0.0000 Buried
122 T F -0.6766 Soluble
123 T F -0.2082 Soluble
124 V F 0.0000 Buried
125 T F 0.0000 Buried
126 V F 0.0000 Buried
127 S F -0.7817 Soluble
128 S F -0.6626 Soluble
129 A F -0.5131 Soluble
130 S F -0.6735 Soluble
131 T F -0.7533 Soluble
132 K F -1.5342 Soluble
133 G F -1.5795 Soluble
134 P F 0.0000 Buried
135 S F -0.5707 Soluble
136 V F 0.0000 Buried
137 F F 0.0000 Buried
138 P F -1.2687 Soluble
139 L F 0.0000 Buried
140 A F -1.4170 Soluble
141 P F 0.0000 Buried
142 S F -1.1361 Soluble
143 S F -0.7318 Soluble
144 K F -1.1115 Soluble
145 S F 0.0000 Buried
146 T F -0.6995 Soluble
147 S F -0.6793 Soluble
148 G F -0.7835 Soluble
149 G F -0.8811 Soluble
150 T F -0.5973 Soluble
151 A F 0.0000 Buried
152 A F 0.0000 Buried
153 L F 0.0000 Buried
154 G F 0.0000 Buried
155 C F 0.0000 Buried
156 L F 0.0000 Buried
157 V F 0.0000 Buried
158 K F 0.0000 Buried
159 D F -0.6767 Soluble
160 Y F 0.0000 Buried
161 F F 0.0000 Buried
162 P F 0.0000 Buried
163 E F -0.2515 Soluble
164 P F -0.5789 Soluble
165 V F -0.5950 Soluble
166 T F -0.5521 Soluble
167 V F -0.3245 Soluble
168 S F -0.3204 Soluble
169 W F 0.0000 Buried
170 N F -0.7084 Soluble
171 S F -0.5786 Soluble
172 G F -0.5587 Soluble
173 A F -0.2325 Soluble
174 L F 0.0116 Aggregation-prone
175 T F -0.1580 Soluble
176 S F -0.1604 Soluble
177 G F -0.2261 Soluble
178 V F 0.1389 Aggregation-prone
179 H F -0.3979 Soluble
180 T F -0.1856 Soluble
181 F F 0.0000 Buried
182 P F -0.3562 Soluble
183 A F 0.4905 Aggregation-prone
184 V F 0.7096 Aggregation-prone
185 L F 1.2468 Aggregation-prone
186 Q F 0.3199 Aggregation-prone
187 S F -0.1185 Soluble
188 S F -0.2693 Soluble
189 G F -0.0019 Soluble
190 L F 0.0497 Aggregation-prone
191 Y F 0.4132 Aggregation-prone
192 S F 0.0000 Buried
193 L F 0.0000 Buried
194 S F 0.0000 Buried
195 S F 0.0000 Buried
196 V F 0.0000 Buried
197 V F 0.0000 Buried
198 T F -0.1040 Soluble
199 V F 0.0000 Buried
200 P F -0.6637 Soluble
201 S F -0.6861 Soluble
202 S F -0.5694 Soluble
203 S F -0.6916 Soluble
204 L F -0.8898 Soluble
205 G F -1.1576 Soluble
206 T F -1.2046 Soluble
207 Q F -1.5674 Soluble
208 T F -1.3137 Soluble
209 Y F 0.0000 Buried
210 I F -1.3100 Soluble
211 C F 0.0000 Buried
212 N F -1.2983 Soluble
213 V F 0.0000 Buried
214 N F -1.9381 Soluble
215 H F 0.0000 Buried
216 K F -2.7183 Soluble
217 P F -1.5880 Soluble
218 S F -1.8855 Soluble
219 N F -2.6479 Soluble
220 T F -2.1359 Soluble
221 K F -2.5592 Soluble
222 V F -1.2307 Soluble
223 D F -1.9206 Soluble
224 K F -1.9137 Soluble
225 R F -2.6398 Soluble
226 V F 0.0000 Buried
227 E F -3.0455 Soluble
228 P F -2.0143 Soluble
229 K F -2.0923 Soluble
230 S F -0.8048 Soluble
231 C F 0.1586 Aggregation-prone
1 D E -1.9067 Soluble
2 I E -1.4406 Soluble
3 Q E -1.6319 Soluble
4 M E -1.0372 Soluble
5 T E -0.5452 Soluble
6 Q E 0.0000 Buried
7 S E -0.5858 Soluble
8 P E -0.5852 Soluble
9 S E -0.8534 Soluble
10 T E -0.8914 Soluble
11 L E -0.7213 Soluble
12 S E -1.0509 Soluble
13 A E -1.1350 Soluble
14 S E -1.0495 Soluble
15 V E -0.2450 Soluble
16 G E -0.8588 Soluble
17 D E -1.8747 Soluble
18 R E -2.3045 Soluble
19 V E 0.0000 Buried
20 T E -0.6383 Soluble
21 I E 0.0000 Buried
22 T E -0.6035 Soluble
23 C E 0.0000 Buried
24 S E -1.2763 Soluble
25 A E 0.0000 Buried
26 S E -1.4583 Soluble
27 S E -1.7537 Soluble
28 R E -2.3103 Soluble
29 V E 0.0000 Buried
37 G E -0.6121 Soluble
38 Y E 0.2627 Aggregation-prone
39 M E 0.0000 Buried
40 H E 0.0000 Buried
41 W E 0.0000 Buried
42 Y E 0.0000 Buried
43 Q E 0.0000 Buried
44 Q E 0.0000 Buried
45 K E -1.8661 Soluble
46 P E -1.4414 Soluble
47 G E -1.6776 Soluble
48 K E -2.5569 Soluble
49 A E -1.7011 Soluble
50 P E 0.0000 Buried
51 K E -1.8144 Soluble
52 L E -0.6101 Soluble
53 L E 0.0000 Buried
54 I E 0.0000 Buried
55 Y E -0.2778 Soluble
56 D E -0.4356 Soluble
57 T E -0.4506 Soluble
65 S E -0.8894 Soluble
66 K E -1.4613 Soluble
67 L E -0.3466 Soluble
68 A E -0.5015 Soluble
69 S E -0.6248 Soluble
70 G E -0.3870 Soluble
71 V E -0.3694 Soluble
72 P E -0.2815 Soluble
74 S E -0.3927 Soluble
75 R E -0.7801 Soluble
76 F E 0.0000 Buried
77 S E -0.5567 Soluble
78 G E -0.6073 Soluble
79 S E -0.8798 Soluble
80 G E -0.9537 Soluble
83 S E -1.2139 Soluble
84 G E -1.6345 Soluble
85 T E -1.8140 Soluble
86 E E -2.3732 Soluble
87 F E 0.0000 Buried
88 T E -0.6830 Soluble
89 L E 0.0000 Buried
90 T E -0.6183 Soluble
91 I E 0.0000 Buried
92 S E -1.3976 Soluble
93 S E -1.1941 Soluble
94 L E 0.0000 Buried
95 Q E -1.1541 Soluble
96 P E -2.1244 Soluble
97 D E -2.4554 Soluble
98 D E 0.0000 Buried
99 F E 0.0000 Buried
100 A E 0.0000 Buried
101 T E -0.9610 Soluble
102 Y E 0.0000 Buried
103 Y E 0.0000 Buried
104 C E 0.0000 Buried
105 F E 0.0000 Buried
106 Q E 0.0000 Buried
107 G E 0.0000 Buried
108 S E -0.1872 Soluble
109 G E -0.2066 Soluble
114 Y E 0.0991 Aggregation-prone
115 P E 0.0000 Buried
116 F E 0.0000 Buried
117 T E -0.6986 Soluble
118 F E 0.0000 Buried
119 G E 0.0000 Buried
120 G E -1.2306 Soluble
121 G E -1.0317 Soluble
122 T E 0.0000 Buried
123 K E -1.9418 Soluble
124 V E 0.0000 Buried
125 E E -1.4773 Soluble
126 I E 0.0000 Buried
127 K E -1.6734 Soluble
128 R E -1.1504 Soluble
129 T E -0.1098 Soluble
130 V E 0.3874 Aggregation-prone
131 A E -0.0254 Soluble
132 A E -0.1141 Soluble
133 P E 0.0000 Buried
134 S E -0.2509 Soluble
135 V E 0.0000 Buried
136 F E 0.0000 Buried
137 I E 0.0000 Buried
138 F E 0.0000 Buried
139 P E -0.6710 Soluble
140 P E 0.0000 Buried
141 S E -1.8334 Soluble
142 D E -2.9325 Soluble
143 E E -2.9641 Soluble
144 Q E 0.0000 Buried
145 L E -2.2350 Soluble
146 K E -2.8873 Soluble
147 S E -1.8695 Soluble
148 G E -1.3800 Soluble
149 T E -1.0123 Soluble
150 A E 0.0000 Buried
151 S E 0.0000 Buried
152 V E 0.0000 Buried
153 V E 0.0000 Buried
154 C E 0.0000 Buried
155 L E 0.0000 Buried
156 L E 0.0000 Buried
157 N E 0.0000 Buried
158 N E -1.2826 Soluble
159 F E 0.0000 Buried
160 Y E 0.0000 Buried
161 P E -1.7770 Soluble
162 R E -2.9169 Soluble
163 E E -3.1934 Soluble
164 A E -2.5192 Soluble
165 K E -2.6084 Soluble
166 V E -1.1545 Soluble
167 Q E -0.5028 Soluble
168 W E 0.0000 Buried
169 K E -0.6078 Soluble
170 V E 0.0000 Buried
171 D E -1.9188 Soluble
172 N E -1.5442 Soluble
173 A E -0.3197 Soluble
174 L E 0.6432 Aggregation-prone
175 Q E -0.2426 Soluble
176 S E -0.4425 Soluble
177 G E -0.8805 Soluble
178 N E -0.8186 Soluble
179 S E -0.9990 Soluble
180 Q E -1.2881 Soluble
181 E E -1.9736 Soluble
182 S E -0.7101 Soluble
183 V E -0.7025 Soluble
184 T E -1.1171 Soluble
185 E E -2.2302 Soluble
186 Q E 0.0000 Buried
187 D E -2.7526 Soluble
188 S E -2.7213 Soluble
189 K E -3.3374 Soluble
190 D E -3.2568 Soluble
191 S E 0.0000 Buried
192 T E 0.0000 Buried
193 Y E 0.0000 Buried
194 S E 0.0000 Buried
195 L E 0.0000 Buried
196 S E 0.0000 Buried
197 S E 0.0000 Buried
198 T E -0.5996 Soluble
199 L E 0.0000 Buried
200 T E -0.2670 Soluble
201 L E -0.4516 Soluble
202 S E -0.8291 Soluble
203 K E -1.8284 Soluble
204 A E -1.5418 Soluble
205 D E -1.9422 Soluble
206 Y E 0.0000 Buried
207 E E -3.0488 Soluble
208 K E -3.2879 Soluble
209 H E -2.7896 Soluble
210 K E -3.2403 Soluble
211 V E -1.4852 Soluble
212 Y E 0.0000 Buried
213 A E 0.0000 Buried
214 C E 0.0000 Buried
215 E E -0.6615 Soluble
216 V E 0.0000 Buried
217 T E -1.1648 Soluble
218 H E 0.0000 Buried
219 Q E -1.6842 Soluble
220 G E -0.3682 Soluble
221 L E -0.1795 Soluble
222 S E -0.4402 Soluble
223 S E -0.4011 Soluble
224 P E -0.5022 Soluble
225 V E 0.1818 Aggregation-prone
226 T E -0.2107 Soluble
227 K E -0.4549 Soluble
228 S E -0.5924 Soluble
229 F E 0.0000 Buried
230 N E -1.9217 Soluble
231 R E -2.5049 Soluble
232 G E -1.9338 Soluble
233 E E -2.0866 Soluble
234 C E -0.4904 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
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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 -0.7745 5.0532 CSV PDB
4.5 -0.8165 5.0532 CSV PDB
5.0 -0.8649 5.0532 CSV PDB
5.5 -0.9097 5.0532 CSV PDB
6.0 -0.9393 5.0532 CSV PDB
6.5 -0.9438 5.0532 CSV PDB
7.0 -0.9229 5.0532 CSV PDB
7.5 -0.8848 5.0532 CSV PDB
8.0 -0.8372 5.0532 CSV PDB
8.5 -0.7824 5.0532 CSV PDB
9.0 -0.7202 5.0532 CSV PDB
Average A4D Score vs pH
Max A4D Score vs pH