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No: | PDB id | Binding Data | Representative ligand | Formula | Smiles |
---|---|---|---|---|---|
The Class containing this family consists of a total of 2 families. | |||||
1 | 4D4B | - | MSX MAN | n/a | n/a |
2 | 5N0F | Kd = 0.9 uM | 7K2 | C12 H23 N O7 S | C1[C@@H]([.... |
3 | 4D4C | Ki = 386.9 uM | DMJ MAN | n/a | n/a |
4 | 4D4D | Kd = 1.12 uM | IFM MAN | n/a | n/a |
5 | 5AGD | - | BMA MAN MAN MAN MAN | n/a | n/a |
No: | PDB id | Binding Data | Representative ligand | Formula | Smiles |
---|---|---|---|---|---|
The Class containing this family consists of a total of 2 families. | |||||
1 | 4D4B | - | MSX MAN | n/a | n/a |
2 | 5N0F | Kd = 0.9 uM | 7K2 | C12 H23 N O7 S | C1[C@@H]([.... |
3 | 4D4C | Ki = 386.9 uM | DMJ MAN | n/a | n/a |
4 | 4D4D | Kd = 1.12 uM | IFM MAN | n/a | n/a |
5 | 5AGD | - | BMA MAN MAN MAN MAN | n/a | n/a |
6 | 5M77 | Kd = 24.7 nM | 7K2 7K3 | n/a | n/a |
No: | Ligand | ECFP6 Tc | MDL keys Tc |
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No: | Ligand | ECFP6 Tc | MDL keys Tc |
---|---|---|---|
1 | BMA MAN MAN MAN MAN | 1 | 1 |
2 | MMA MAN MAN | 0.616438 | 0.891892 |
3 | BMA MAN MAN | 0.567568 | 0.942857 |
4 | BMA MAN MAN MAN | 0.536585 | 0.868421 |
5 | BGC BGC BGC BGC | 0.530864 | 0.942857 |
6 | NAG BMA MAN MAN MAN MAN MAN | 0.511364 | 0.825 |
7 | NAG BMA MAN MAN MAN MAN MAN MAN MAN | 0.510204 | 0.73913 |
8 | BMA NGT MAN MAN | 0.505376 | 0.666667 |
9 | NAG NAG MAN MAN MAN | 0.494845 | 0.693878 |
10 | MAN BMA MAN MAN MAN MAN MAN | 0.483871 | 0.891892 |
11 | NDG BMA MAN MAN NAG MAN MAN | 0.481132 | 0.693878 |
12 | NAG BMA MAN MAN MAN MAN | 0.479167 | 0.73913 |
13 | H1M MAN MAN | 0.47619 | 0.825 |
14 | BGC GLC GLC | 0.475 | 0.942857 |
15 | MAN MAN MAN | 0.465116 | 0.916667 |
16 | MAN AML MAN MAN MAN MAN MAN MAN MAN | 0.463918 | 0.785714 |
17 | NAG BMA MAN MAN MAN MAN MAN MAN MAN MAN | 0.460784 | 0.73913 |
18 | BGC GLC GLC GLC GLC | 0.459459 | 0.942857 |
19 | BGC GLC GLC GLC GLC GLC | 0.459459 | 0.942857 |
20 | MAN MAN BMA | 0.45679 | 0.891892 |
21 | BGC GLC GLC GLC | 0.452381 | 0.942857 |
22 | GLC GLC GLC GLC GLC | 0.452381 | 0.942857 |
23 | 1GN ACY GAL 1GN BGC ACY GAL BGC | 0.44898 | 0.693878 |
24 | MAN MAN MAN MAN MAN MAN MAN | 0.445652 | 0.942857 |
25 | GLC GLC GLC | 0.440476 | 0.891892 |
26 | NAG NAG BMA MAN MAN MAN MAN MAN MAN MAN | 0.432432 | 0.693878 |
27 | BMA BMA BMA BMA GLA | 0.430233 | 0.942857 |
28 | MBG GAL | 0.426667 | 0.891892 |
29 | MMA MAN | 0.426667 | 0.891892 |
30 | YZ0 MAN MAN NAG MAN | 0.425743 | 0.708333 |
31 | GAL SO4 GAL | 0.421687 | 0.634615 |
32 | OPM MAN MAN | 0.41573 | 0.767442 |
33 | BQZ | 0.414286 | 0.857143 |
34 | KDO MAN MAN MAN MAN MAN | 0.410714 | 0.921053 |
35 | BMA BMA BMA BMA GLA BMA GLA | 0.410526 | 0.972222 |
36 | GLC BGC BGC BGC | 0.410256 | 0.942857 |
37 | BGC BGC BGC BGC BGC | 0.410256 | 0.942857 |
38 | BGC BGC BGC BGC BGC BGC | 0.410256 | 0.942857 |
39 | BGC BGC BGC BGC BGC BGC BGC | 0.410256 | 0.942857 |
40 | BGC BGC BGC | 0.410256 | 0.942857 |
41 | BGC GAL GLA | 0.407407 | 0.942857 |
42 | AHR AHR AHR AHR AHR AHR | 0.405405 | 0.810811 |
43 | AHR AHR AHR AHR AHR | 0.405405 | 0.810811 |
44 | AHR AHR AHR AHR | 0.405405 | 0.810811 |
45 | GLC FRU GLA GLA GLA | 0.402299 | 0.846154 |
46 | GLC FRU GLA GLA | 0.402299 | 0.846154 |
47 | NAG NAG BMA MAN MAN MAN MAN | 0.4 | 0.641509 |
48 | GAL GLA | 0.4 | 0.942857 |
No: | Ligand | Similarity coefficient |
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No: | Ligand | Similarity coefficient |
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This union binding pocket(no: 1) in the query (biounit: 5n0f.bio1) has 13 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |
This union binding pocket(no: 2) in the query (biounit: 5n0f.bio2) has 18 residues | |||
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No: | Leader PDB | Ligand | Sequence Similarity |