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- Structure Biounit | Ligand Information
- PDB : .ZIP | .CSV
- Family 90% : .ZIP | .CSV
- Class : .ZIP | .CSV
No: | PDB id | Binding Data | Representative ligand | Formula | Smiles |
---|---|---|---|---|---|
The Class containing this family consists of a total of 277 families. | |||||
1 | 3SFY | - | 3FY | C25 H29 Br N6 O2 S | Cc1ccccc1C.... |
2 | 3Q7F | - | ED2 | C25 H27 N7 O2 S | Cn1cc(nc1).... |
3 | 3Q7A | - | 778 | C22 H20 Cl N5 O | c1cc(cc(c1.... |
4 | 3Q75 | - | FII | C17 H30 N O5 P | CC(=CCC/C(.... |
5 | 3SFX | - | FII | C17 H30 N O5 P | CC(=CCC/C(.... |
No: | PDB id | Binding Data | Representative ligand | Formula | Smiles |
---|---|---|---|---|---|
The Class containing this family consists of a total of 212 families. | |||||
1 | 3SFY | - | 3FY | C25 H29 Br N6 O2 S | Cc1ccccc1C.... |
2 | 3Q7F | - | ED2 | C25 H27 N7 O2 S | Cn1cc(nc1).... |
3 | 3Q7A | - | 778 | C22 H20 Cl N5 O | c1cc(cc(c1.... |
4 | 3Q75 | - | FII | C17 H30 N O5 P | CC(=CCC/C(.... |
5 | 3SFX | - | FII | C17 H30 N O5 P | CC(=CCC/C(.... |
No: | Ligand | ECFP6 Tc | MDL keys Tc |
---|---|---|---|
1 | FII | 1 | 1 |
2 | DSL | 0.553571 | 0.603448 |
3 | 0K3 | 0.553571 | 0.603448 |
4 | FJP | 0.553571 | 0.614035 |
5 | GRG | 0.507937 | 0.666667 |
6 | FPP | 0.507937 | 0.666667 |
7 | VTP | 0.507937 | 0.655172 |
8 | OTP | 0.507937 | 0.655172 |
9 | ZTP | 0.507937 | 0.655172 |
10 | FPQ | 0.5 | 0.683333 |
11 | GPP | 0.444444 | 0.649123 |
12 | C0X | 0.444444 | 0.622951 |
13 | FPS | 0.41791 | 0.6 |
14 | GGS | 0.41791 | 0.6 |
15 | FFF | 0.402778 | 0.633333 |
No: | Ligand | Similarity coefficient |
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No: | Ligand | Similarity coefficient |
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