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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 19 families. | |||||
1 | 4E93 | ic50 = 45.8 nM | GUI | C30 H40 Cl N7 O3 S | CC(C)S(=O).... |
2 | 3BKB | - | STU | C28 H26 N4 O3 | C[C@@]12[C.... |
3 | 3CD3 | - | STU | C28 H26 N4 O3 | C[C@@]12[C.... |
4 | 3CBL | - | STU | C28 H26 N4 O3 | C[C@@]12[C.... |
5 | 6JMF | - | 9FC | C20 H24 N6 O | Cc1cccc(c1.... |
No: | PDB id | Binding Data | Representative ligand | Formula | Smiles |
---|---|---|---|---|---|
The Class containing this family consists of a total of 7 families. | |||||
1 | 4E93 | ic50 = 45.8 nM | GUI | C30 H40 Cl N7 O3 S | CC(C)S(=O).... |
2 | 3BKB | - | STU | C28 H26 N4 O3 | C[C@@]12[C.... |
3 | 3CD3 | - | STU | C28 H26 N4 O3 | C[C@@]12[C.... |
4 | 3CBL | - | STU | C28 H26 N4 O3 | C[C@@]12[C.... |
5 | 6JMF | - | 9FC | C20 H24 N6 O | Cc1cccc(c1.... |
No: | Ligand | Similarity coefficient |
---|
This union binding pocket(no: 1) in the query (biounit: 4e93.bio1) has 36 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |
1 | 4H3P | ANP | 25.6906 |
2 | 1O9U | ADZ | 27.7143 |
3 | 1PHK | ATP | 28.1879 |
4 | 5JZJ | AN2 | 30.6397 |
5 | 6YLC | OXW | 31.0345 |
6 | 4CFU | 2WC | 32.3432 |
7 | 6GUE | FB8 | 32.4503 |
8 | 4BCN | T9N | 32.6667 |
9 | 1U5R | ATP | 33.046 |
10 | 1UNH | IXM | 34.589 |
11 | 5LPB | ADP | 35.473 |
12 | 5AX9 | 4KT | 37.013 |
13 | 2VN9 | GVD | 37.8738 |
14 | 5WNL | STU | 38.0117 |
15 | 3DAK | ANP | 43.4483 |
16 | 6F3G | CJN | 44.0678 |
17 | 1JPA | ANP | 48.0769 |