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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 2 families. | |||||
1 | 2RKU | ic50 = 8 nM | R78 | C28 H39 N7 O3 | CC[C@@H]1C.... |
2 | 4J53 | ic50 = 2 nM | 1J4 | C27 H34 F3 N7 O3 | CN1CCC(CC1.... |
3 | 2YAC | ic50 = 0.002 uM | 937 | C24 H27 F3 N8 O3 | CN1CCN(CC1.... |
4 | 4J52 | ic50 = 3 nM | 1J3 | C28 H37 F N8 O3 | CN1CCN(CC1.... |
5 | 3FC2 | ic50 = 0.87 nM | IBI | C34 H50 N8 O3 | CC[C@@H]1C.... |
6 | 4A4L | ic50 = 0.015 uM | 939 | C22 H24 F3 N7 O2 | Cn1cc(cc1c.... |
7 | 2OU7 | ic50 = 155 uM | ANP | C10 H17 N6 O12 P3 | c1nc(c2c(n.... |
8 | 3KB7 | ic50 = 0.007 uM | 071 | C23 H28 N8 O2 | Cn1c-2c(c(.... |
9 | 3THB | ic50 = 2 nM | 3TA | C23 H25 Cl N6 S | Cc1c(cc(cn.... |
10 | 2OWB | ic50 = 0.44 uM | 626 | C23 H24 N6 O2 S | CN1CCN(CC1.... |
11 | 5TA6 | ic50 = 1.5 nM | 79D | C30 H37 N9 O2 | CC[C@@H]1c.... |
No: | PDB id | Binding Data | Representative ligand | Formula | Smiles |
---|---|---|---|---|---|
The Class containing this family consists of a total of 1 families. | |||||
1 | 4I5M | ic50 = 0.0088 uM | R78 | C28 H39 N7 O3 | CC[C@@H]1C.... |
2 | 4I6H | ic50 = 0.005 uM | 1C8 | C20 H23 N7 O S | CC[C@@H]1C.... |
3 | 4I5P | ic50 = 0.377 uM | 1D1 | C18 H23 N5 O | CC[C@@H]1C.... |
4 | 4I6B | ic50 = 1.17 uM | 11G | C14 H20 N4 O | CC[C@@H]1C.... |
5 | 2RKU | ic50 = 8 nM | R78 | C28 H39 N7 O3 | CC[C@@H]1C.... |
6 | 4J53 | ic50 = 2 nM | 1J4 | C27 H34 F3 N7 O3 | CN1CCC(CC1.... |
7 | 2YAC | ic50 = 0.002 uM | 937 | C24 H27 F3 N8 O3 | CN1CCN(CC1.... |
8 | 4J52 | ic50 = 3 nM | 1J3 | C28 H37 F N8 O3 | CN1CCN(CC1.... |
9 | 3FC2 | ic50 = 0.87 nM | IBI | C34 H50 N8 O3 | CC[C@@H]1C.... |
10 | 4A4L | ic50 = 0.015 uM | 939 | C22 H24 F3 N7 O2 | Cn1cc(cc1c.... |
11 | 2OU7 | ic50 = 155 uM | ANP | C10 H17 N6 O12 P3 | c1nc(c2c(n.... |
12 | 3KB7 | ic50 = 0.007 uM | 071 | C23 H28 N8 O2 | Cn1c-2c(c(.... |
13 | 3THB | ic50 = 2 nM | 3TA | C23 H25 Cl N6 S | Cc1c(cc(cn.... |
14 | 2OWB | ic50 = 0.44 uM | 626 | C23 H24 N6 O2 S | CN1CCN(CC1.... |
15 | 5TA6 | ic50 = 1.5 nM | 79D | C30 H37 N9 O2 | CC[C@@H]1c.... |
This union binding pocket(no: 1) in the query (biounit: 5ta6.bio1) has 28 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |
1 | 3GC0 | AMP | 27.9635 |
2 | 6YLC | OXW | 32.2884 |
3 | 6YLC | OXW | 32.2884 |
4 | 6YLC | OXW | 32.2884 |
5 | 1O9U | ADZ | 33.4286 |
6 | 4BCM | T7Z | 33.7989 |
7 | 4BCM | T7Z | 33.7989 |
8 | 3PLS | ANP | 38.255 |
9 | 3HMO | STU | 38.3041 |
10 | 3HMO | STU | 38.3041 |
11 | 1K3A | ACP | 38.4615 |
12 | 3DAK | ANP | 38.6207 |
13 | 4UXL | 5P8 | 41.3043 |
14 | 2HY0 | 306 | 43.4783 |
15 | 2VN9 | GVD | 43.5216 |
16 | 2VN9 | GVD | 43.5216 |
17 | 4WNP | 3RJ | 45.2962 |
18 | 2A19 | ANP | 46.831 |