Motavizumab / 4jlr

A4DAB172_4jlr_H_L | Source PDB: 4jlr | Chains: H, L | Done
99.12
Yes
10 Å
Yes
Avg A4D Score
-0.6604
Max Score
2.6578
Min Score
-3.9701
Total Score
-280.67
Score CDR
-0.1839
Score non-CDR
-0.7182

Calculation Parameters

Chain Sequence(s) QVTLRESGPALVKPTQTLTLTCTFSGFSLSTAGMSVGWIRQPPGKALEWLADIWWDDKKHYNPSLKDRLTISKDTSANQVVLKVTNMDPADTATYYCARDMIFNFYFDVWGQGTTVTVSSASTKGPSVFPLAPSSGTAALGCLVKDYFPEPVTVSWNSGALTSGVHTFPAVLQSSGLYSLSSVVTVPSSSLGTQTYICNVNHKPSNTKVDKKVEPDIQMTQSPSTLSASVGDRVTITCSASSRVGYMHWYQQKPGKAPKLLIYDTSKLASGVPSRFSGSGSGTAFTLTISSLQPDDFATYYCFQGSGYPFTFGGGTKVEIKRTVAAPSVFIFPPSDEQLKSGTASVVCLLNNFYPREAKVQWKVDNALQSGNSQESVTEQDSKDSTYSLSSTLTLSKADYEKHKVYACEVTHQGLSSPVTKSFNR input.pdb
Selected Chain(s) H (Heavy), L (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 -3.9701
Maximum Score 2.6578
Average Score -0.6604
Total Score -280.6693

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

Index Residue Chain A4D Score Classification
1 Q H -1.1581 Soluble
2 V H -0.3418 Soluble
3 T H -0.7760 Soluble
4 L H 0.0000 Buried
5 R H -2.2461 Soluble
6 E H 0.0000 Buried
7 S H -0.7423 Soluble
8 G H -0.3835 Soluble
9 P H -0.4161 Soluble
11 A H -0.4195 Soluble
12 L H -0.2642 Soluble
13 V H 0.0000 Buried
14 K H -2.1076 Soluble
15 P H -2.0160 Soluble
16 T H -1.9718 Soluble
17 Q H -2.0935 Soluble
18 T H -1.5619 Soluble
19 L H 0.0000 Buried
20 T H -0.5423 Soluble
21 L H 0.0000 Buried
22 T H -0.5261 Soluble
23 C H 0.0000 Buried
24 T H -1.0832 Soluble
25 F H 0.0000 Buried
26 S H -0.8427 Soluble
27 G H -0.7470 Soluble
28 F H -0.2782 Soluble
29 S H -0.2311 Soluble
30 L H 0.0000 Buried
31 S H -0.7284 Soluble
34 T H -0.1815 Soluble
35 A H 0.0324 Aggregation-prone
36 G H 0.0000 Buried
37 M H 0.5761 Aggregation-prone
38 S H 0.0000 Buried
39 V H 0.0000 Buried
40 G H 0.0000 Buried
41 W H 0.0000 Buried
42 I H 0.0000 Buried
43 R H 0.0000 Buried
44 Q H -0.8678 Soluble
45 P H -0.9824 Soluble
46 P H -1.1032 Soluble
47 G H -1.4881 Soluble
48 K H -2.1823 Soluble
49 A H -1.2706 Soluble
50 L H 0.0000 Buried
51 E H -0.8383 Soluble
52 W H 0.0000 Buried
53 L H 0.0000 Buried
54 A H 0.0000 Buried
55 D H 0.0000 Buried
56 I H 0.0000 Buried
57 W H 0.0000 Buried
58 W H -1.1654 Soluble
59 D H -2.2886 Soluble
63 D H -2.6912 Soluble
64 K H -2.4046 Soluble
65 K H -1.7449 Soluble
66 H H -0.4628 Soluble
67 Y H -0.3282 Soluble
68 N H 0.0000 Buried
69 P H -1.2802 Soluble
70 S H -1.1150 Soluble
71 L H 0.0000 Buried
72 K H -2.7118 Soluble
74 D H -2.7838 Soluble
75 R H -2.1745 Soluble
76 L H 0.0000 Buried
77 T H -0.7694 Soluble
78 I H 0.0000 Buried
79 S H -1.1471 Soluble
80 K H -1.5320 Soluble
81 D H -2.1969 Soluble
82 T H -1.3175 Soluble
83 S H -0.9875 Soluble
84 A H -0.9629 Soluble
85 N H -1.1838 Soluble
86 Q H -1.3953 Soluble
87 V H 0.0000 Buried
88 V H -0.3484 Soluble
89 L H 0.0000 Buried
90 K H -0.9521 Soluble
91 V H 0.0000 Buried
92 T H -1.7774 Soluble
93 N H -2.3407 Soluble
94 M H 0.0000 Buried
95 D H -2.6117 Soluble
96 P H -1.3101 Soluble
97 A H -0.6292 Soluble
98 D H 0.0000 Buried
99 T H -0.4495 Soluble
100 A H 0.0000 Buried
101 T H -0.3238 Soluble
102 Y H 0.0000 Buried
103 Y H 0.0000 Buried
104 C H 0.0000 Buried
105 A H 0.0000 Buried
106 R H 0.0000 Buried
107 D H 0.0000 Buried
108 M H 1.5480 Aggregation-prone
109 I H 2.3966 Aggregation-prone
110 F H 2.6578 Aggregation-prone
112 N H 1.3999 Aggregation-prone
113 F H 1.3471 Aggregation-prone
114 Y H 0.0000 Buried
115 F H 0.0000 Buried
116 D H -0.3697 Soluble
117 V H -0.0513 Soluble
118 W H -0.6993 Soluble
119 G H 0.0000 Buried
120 Q H -2.0134 Soluble
121 G H 0.0000 Buried
122 T H -0.6868 Soluble
123 T H -0.3678 Soluble
124 V H 0.0000 Buried
125 T H -0.5099 Soluble
126 V H 0.0000 Buried
127 S H -0.9064 Soluble
128 S H -0.7124 Soluble
129 A H -0.5008 Soluble
130 S H -0.6431 Soluble
131 T H -0.8379 Soluble
132 K H -1.3897 Soluble
133 G H -1.4788 Soluble
134 P H -0.7075 Soluble
135 S H -0.3833 Soluble
136 V H 0.0000 Buried
137 F H -0.5340 Soluble
138 P H 0.0000 Buried
139 L H 0.0000 Buried
140 A H -0.7281 Soluble
141 P H -0.4746 Soluble
142 S H -0.5526 Soluble
143 S H -0.3501 Soluble
144 G H -0.6328 Soluble
145 T H -0.4853 Soluble
146 A H -0.2747 Soluble
147 A H 0.0000 Buried
148 L H 0.0000 Buried
149 G H 0.0000 Buried
150 C H 0.0000 Buried
151 L H 0.0000 Buried
152 V H 0.0000 Buried
153 K H 0.0000 Buried
154 D H -0.6225 Soluble
155 Y H 0.0000 Buried
156 F H 0.0000 Buried
157 P H 0.0000 Buried
158 E H -0.4793 Soluble
159 P H -0.7225 Soluble
160 V H -0.6672 Soluble
161 T H -0.5644 Soluble
162 V H -0.3536 Soluble
163 S H -0.3882 Soluble
164 W H 0.0000 Buried
165 N H -0.7915 Soluble
166 S H -0.6820 Soluble
167 G H -0.5736 Soluble
168 A H -0.2464 Soluble
169 L H -0.0045 Soluble
170 T H -0.1755 Soluble
171 S H -0.1717 Soluble
172 G H -0.1957 Soluble
173 V H 0.1796 Aggregation-prone
174 H H -0.2920 Soluble
175 T H -0.0020 Soluble
176 F H 0.0000 Buried
177 P H -0.3032 Soluble
178 A H 0.4434 Aggregation-prone
179 V H 0.6131 Aggregation-prone
180 L H 1.4741 Aggregation-prone
181 Q H 0.2815 Aggregation-prone
182 S H -0.0398 Soluble
183 S H -0.2239 Soluble
184 G H 0.0823 Aggregation-prone
185 L H 0.0976 Aggregation-prone
186 Y H 0.4673 Aggregation-prone
187 S H 0.0000 Buried
188 L H 0.0000 Buried
189 S H 0.0000 Buried
190 S H 0.0000 Buried
191 V H 0.0000 Buried
192 V H 0.0000 Buried
193 T H -0.1439 Soluble
194 V H 0.0000 Buried
195 P H -0.4758 Soluble
196 S H -0.5337 Soluble
197 S H -0.5787 Soluble
198 S H -0.5740 Soluble
199 L H -0.8128 Soluble
200 G H -1.0852 Soluble
201 T H -0.8978 Soluble
202 Q H -1.1882 Soluble
203 T H -1.1053 Soluble
204 Y H 0.0000 Buried
205 I H -1.2520 Soluble
206 C H 0.0000 Buried
207 N H -1.4969 Soluble
208 V H 0.0000 Buried
209 N H -1.9141 Soluble
210 H H 0.0000 Buried
211 K H -2.7515 Soluble
212 P H -1.5979 Soluble
213 S H -1.8728 Soluble
214 N H -2.6296 Soluble
215 T H -2.1136 Soluble
216 K H -2.6754 Soluble
217 V H -1.6996 Soluble
218 D H -2.6031 Soluble
219 K H -2.0941 Soluble
220 K H -2.5544 Soluble
221 V H 0.0000 Buried
222 E H -2.5365 Soluble
223 P H -1.4425 Soluble
1 D L -1.9336 Soluble
2 I L -1.5367 Soluble
3 Q L -1.6898 Soluble
4 M L 0.0000 Buried
5 T L -0.5988 Soluble
6 Q L 0.0000 Buried
7 S L -0.3948 Soluble
8 P L -0.4025 Soluble
9 S L -0.5858 Soluble
10 T L -0.5159 Soluble
11 L L -0.4101 Soluble
12 S L -0.7118 Soluble
13 A L -1.0184 Soluble
14 S L -1.0102 Soluble
15 V L -0.3894 Soluble
16 G L -0.9971 Soluble
17 D L -1.9946 Soluble
18 R L -2.4463 Soluble
19 V L 0.0000 Buried
20 T L -0.6400 Soluble
21 I L 0.0000 Buried
22 T L -0.2519 Soluble
23 C L 0.0000 Buried
24 S L -0.6997 Soluble
25 A L -0.9605 Soluble
26 S L -1.3033 Soluble
27 S L -1.6103 Soluble
28 R L -2.0110 Soluble
29 V L 0.0000 Buried
37 G L -0.4755 Soluble
38 Y L 0.5418 Aggregation-prone
39 M L 0.0000 Buried
40 H L 0.0000 Buried
41 W L 0.0000 Buried
42 Y L 0.0000 Buried
43 Q L 0.0000 Buried
44 Q L 0.0000 Buried
45 K L -1.6586 Soluble
46 P L -1.5045 Soluble
47 G L -1.8215 Soluble
48 K L -2.4125 Soluble
49 A L -1.5646 Soluble
50 P L 0.0000 Buried
51 K L -1.2729 Soluble
52 L L 0.0000 Buried
53 L L 0.0000 Buried
54 I L 0.0000 Buried
55 Y L -0.0389 Soluble
56 D L -0.1078 Soluble
57 T L -0.2592 Soluble
65 S L -0.6880 Soluble
66 K L -1.1645 Soluble
67 L L -0.1684 Soluble
68 A L -0.3444 Soluble
69 S L -0.4307 Soluble
70 G L -0.4427 Soluble
71 V L -0.2418 Soluble
72 P L -0.2987 Soluble
74 S L -0.3826 Soluble
75 R L -0.8158 Soluble
76 F L 0.0000 Buried
77 S L -0.4633 Soluble
78 G L -0.5165 Soluble
79 S L -0.5775 Soluble
80 G L -0.4933 Soluble
83 S L -0.6553 Soluble
84 G L -1.0184 Soluble
85 T L -0.8923 Soluble
86 A L -0.5532 Soluble
87 F L 0.0000 Buried
88 T L -0.3141 Soluble
89 L L 0.0000 Buried
90 T L -0.5891 Soluble
91 I L 0.0000 Buried
92 S L -1.3930 Soluble
93 S L -1.2788 Soluble
94 L L 0.0000 Buried
95 Q L -1.0380 Soluble
96 P L -1.6102 Soluble
97 D L -1.8641 Soluble
98 D L 0.0000 Buried
99 F L 0.0000 Buried
100 A L 0.0000 Buried
101 T L -0.5597 Soluble
102 Y L 0.0000 Buried
103 Y L 0.0000 Buried
104 C L 0.0000 Buried
105 F L 0.0000 Buried
106 Q L 0.0000 Buried
107 G L 0.0000 Buried
108 S L -0.1260 Soluble
109 G L -0.2437 Soluble
114 Y L 0.0770 Aggregation-prone
115 P L 0.0000 Buried
116 F L 0.0000 Buried
117 T L -0.6345 Soluble
118 F L 0.0000 Buried
119 G L 0.0000 Buried
120 G L -1.0264 Soluble
121 G L 0.0000 Buried
122 T L 0.0000 Buried
123 K L -0.9264 Soluble
124 V L 0.0000 Buried
125 E L -1.1661 Soluble
126 I L 0.0000 Buried
127 K L -1.1389 Soluble
128 R L -0.8439 Soluble
129 T L -0.0553 Soluble
130 V L 0.5980 Aggregation-prone
131 A L 0.1740 Aggregation-prone
132 A L -0.1193 Soluble
133 P L 0.0000 Buried
134 S L -0.1533 Soluble
135 V L 0.0000 Buried
136 F L 0.1159 Aggregation-prone
137 I L 0.0852 Aggregation-prone
138 F L 0.0000 Buried
139 P L -0.6907 Soluble
140 P L 0.0000 Buried
141 S L -1.3357 Soluble
142 D L -2.5722 Soluble
143 E L -2.1855 Soluble
144 Q L 0.0000 Buried
145 L L -2.1249 Soluble
146 K L -2.6378 Soluble
147 S L -1.6692 Soluble
148 G L -1.1631 Soluble
149 T L -0.9052 Soluble
150 A L 0.0000 Buried
151 S L 0.0000 Buried
152 V L 0.0000 Buried
153 V L 0.0000 Buried
154 C L 0.0000 Buried
155 L L 0.0000 Buried
156 L L 0.0000 Buried
157 N L 0.0000 Buried
158 N L -0.8379 Soluble
159 F L 0.0000 Buried
160 Y L 0.0000 Buried
161 P L -1.7278 Soluble
162 R L -3.0867 Soluble
163 E L -3.1146 Soluble
164 A L -2.0466 Soluble
165 K L -1.7806 Soluble
166 V L -0.7987 Soluble
167 Q L -0.6015 Soluble
168 W L 0.0000 Buried
169 K L -0.9887 Soluble
170 V L 0.0000 Buried
171 D L -2.1398 Soluble
172 N L -1.5425 Soluble
173 A L -0.5781 Soluble
174 L L 0.1728 Aggregation-prone
175 Q L -0.3766 Soluble
176 S L -0.5339 Soluble
177 G L -0.9512 Soluble
178 N L -0.8958 Soluble
179 S L -1.3337 Soluble
180 Q L -2.0306 Soluble
181 E L -2.1430 Soluble
182 S L -0.9086 Soluble
183 V L -0.6564 Soluble
184 T L -1.0471 Soluble
185 E L -2.1749 Soluble
186 Q L 0.0000 Buried
187 D L -2.0469 Soluble
188 S L -2.2255 Soluble
189 K L -2.5731 Soluble
190 D L -1.9125 Soluble
191 S L 0.0000 Buried
192 T L 0.0000 Buried
193 Y L -1.2384 Soluble
194 S L 0.0000 Buried
195 L L 0.0000 Buried
196 S L 0.0000 Buried
197 S L 0.0000 Buried
198 T L -0.8307 Soluble
199 L L 0.0000 Buried
200 T L -0.4713 Soluble
201 L L -0.6541 Soluble
202 S L -1.1199 Soluble
203 K L -2.1996 Soluble
204 A L -1.9209 Soluble
205 D L -2.4891 Soluble
206 Y L 0.0000 Buried
207 E L -3.9701 Soluble
208 K L -3.9161 Soluble
209 H L -3.5025 Soluble
210 K L -3.6954 Soluble
211 V L -2.0336 Soluble
212 Y L 0.0000 Buried
213 A L -0.8031 Soluble
214 C L 0.0000 Buried
215 E L -0.6552 Soluble
216 V L 0.0000 Buried
217 T L -0.9217 Soluble
218 H L 0.0000 Buried
219 Q L -1.6966 Soluble
220 G L -0.4612 Soluble
221 L L -0.2437 Soluble
222 S L -0.4904 Soluble
223 S L -0.4233 Soluble
224 P L -0.4070 Soluble
225 V L 0.0957 Aggregation-prone
226 T L -0.4098 Soluble
227 K L -0.6241 Soluble
228 S L -0.6418 Soluble
229 F L -1.1521 Soluble
230 N L -2.6309 Soluble
231 R L -3.5325 Soluble

3D Structure — colored by A4D score

Sequence - click residue to focus in viewer  |  colored by A4D score
Load structure to view sequence…
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 -0.6624 5.3772 CSV PDB
4.5 -0.7042 5.3772 CSV PDB
5.0 -0.7522 5.3772 CSV PDB
5.5 -0.7971 5.3772 CSV PDB
6.0 -0.829 5.3772 CSV PDB
6.5 -0.8401 5.3772 CSV PDB
7.0 -0.8305 5.3772 CSV PDB
7.5 -0.8073 5.3772 CSV PDB
8.0 -0.7764 5.3772 CSV PDB
8.5 -0.739 5.3772 CSV PDB
9.0 -0.694 5.3772 CSV PDB
Average A4D Score vs pH
Max A4D Score vs pH