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- Structure Biounit | Ligand Information
- PDB : .ZIP | .CSV
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- Class : .ZIP | .CSV
No: | PDB id | Binding Data | Representative ligand | Formula | Smiles |
---|---|---|---|---|---|
The Class containing this family consists of a total of 426 families. | |||||
1 | 4CJ6 | - | RET | C20 H28 O | CC1=C(C(CC.... |
2 | 3HX3 | Kd ~ 10 nM | RET | C20 H28 O | CC1=C(C(CC.... |
No: | PDB id | Binding Data | Representative ligand | Formula | Smiles |
---|---|---|---|---|---|
The Class containing this family consists of a total of 322 families. | |||||
1 | 4CJ6 | - | RET | C20 H28 O | CC1=C(C(CC.... |
2 | 3HX3 | Kd ~ 10 nM | RET | C20 H28 O | CC1=C(C(CC.... |
No: | Ligand | ECFP6 Tc | MDL keys Tc |
---|---|---|---|
1 | RET | 1 | 1 |
2 | BCR | 0.811321 | 0.863636 |
3 | AZE | 0.75 | 0.904762 |
4 | REA | 0.704918 | 0.84 |
5 | 9CR | 0.704918 | 0.84 |
6 | RNE | 0.688525 | 0.655172 |
7 | RTL | 0.688525 | 0.740741 |
8 | ECH | 0.647059 | 0.84 |
9 | ETR | 0.641791 | 0.636364 |
10 | QVM | 0.464789 | 0.642857 |
11 | 45D | 0.455882 | 0.714286 |
12 | 6KX | 0.425926 | 0.952381 |
13 | EQ3 | 0.404762 | 0.666667 |
This union binding pocket(no: 1) in the query (biounit: 3hx3.bio1) has 21 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |