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No: | PDB id | Binding Data | Representative ligand | Formula | Smiles |
---|---|---|---|---|---|
The Class containing this family consists of a total of 41 families. | |||||
1 | 4DE2 | Ki = 76 uM | DN3 | C17 H18 N6 O | CN(C)Cc1cc.... |
No: | PDB id | Binding Data | Representative ligand | Formula | Smiles |
---|---|---|---|---|---|
The Class containing this family consists of a total of 23 families. | |||||
1 | 4DE2 | Ki = 76 uM | DN3 | C17 H18 N6 O | CN(C)Cc1cc.... |
No: | Ligand | Similarity coefficient |
---|---|---|
1 | 7M3 | 0.9035 |
2 | 3GK | 0.8957 |
3 | 762 | 0.8875 |
4 | 133 | 0.8874 |
5 | 950 | 0.8874 |
6 | E7E | 0.8862 |
7 | 972 | 0.8855 |
8 | M94 | 0.8828 |
9 | 49J | 0.8823 |
10 | TUE | 0.8815 |
11 | 132 | 0.8790 |
12 | 696 | 0.8777 |
13 | CR3 | 0.8776 |
14 | OVJ | 0.8775 |
15 | 477 | 0.8760 |
16 | 780 | 0.8755 |
17 | 130 | 0.8733 |
18 | 991 | 0.8731 |
19 | 3XK | 0.8719 |
20 | 655 | 0.8706 |
21 | 656 | 0.8704 |
22 | 3SE | 0.8695 |
23 | 6M8 | 0.8662 |
24 | 5WD | 0.8660 |
25 | 2SN | 0.8654 |
26 | 785 | 0.8648 |
27 | XEB | 0.8605 |
28 | FO5 | 0.8588 |
29 | LS5 | 0.8577 |
30 | MJP | 0.8538 |
This union binding pocket(no: 1) in the query (biounit: 4de2.bio1) has 9 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |
This union binding pocket(no: 2) in the query (biounit: 4de2.bio1) has 15 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |
This union binding pocket(no: 3) in the query (biounit: 4de2.bio2) has 7 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |
This union binding pocket(no: 4) in the query (biounit: 4de2.bio2) has 15 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |