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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 3 families. | |||||
1 | 4ZT4 | - | 4RO | C16 H15 Cl2 F2 N5 | c1cc2c(nc1.... |
2 | 4MW1 | - | 44F | C16 H20 Cl N3 O2 S | COc1cc(cc(.... |
3 | 4MWE | - | 2EN | C21 H26 Cl N3 O2 S | C=CCc1cc(c.... |
4 | 4ZT5 | - | 4RN | C17 H19 Cl2 N5 | C[C@@H](CN.... |
5 | 4ZT7 | - | 4RC | C18 H19 Cl2 F N6 | c1cc(nc2c1.... |
6 | 4MVY | - | 387 | C17 H19 Cl2 N3 O2 | c1cc(cc(c1.... |
7 | 5J59 | ic50 < 50 nM | N93 | C16 H16 Cl3 N5 | CN(CCNCc1c.... |
8 | 4MWB | - | 2EK | C13 H15 Cl2 N3 O S2 | c1cscc1NC(.... |
9 | 5V49 | ic50 < 50 nM | 8WA | C18 H19 Cl3 N6 | CN(CCN[C@@.... |
10 | 4MW0 | - | 392 | C17 H19 Cl2 N3 O2 | c1ccc(c(c1.... |
11 | 4MW5 | - | 415 | C18 H22 Cl N3 O2 | COc1cc(cc(.... |
12 | 4ZT6 | - | 4RD | C18 H18 Cl2 F N5 O | c1cc(nc2c1.... |
13 | 4MW4 | - | MET | C5 H11 N O2 S | CSCC[C@@H].... |
14 | 4MW2 | - | MET | C5 H11 N O2 S | CSCC[C@@H].... |
15 | 4MWD | - | ACP | C11 H18 N5 O12 P3 | c1nc(c2c(n.... |
16 | 6SWX | ic50 = 2.06 uM | LWN | C15 H14 F2 N6 O2 | Cn1c2c(cn1.... |
17 | 3KFL | - | ME8 | C15 H23 N6 O8 P S | CSCC[C@@H].... |
No: | PDB id | Binding Data | Representative ligand | Formula | Smiles |
---|---|---|---|---|---|
The Class containing this family consists of a total of 2 families. | |||||
1 | 2X1L | - | ADN | C10 H13 N5 O4 | c1nc(c2c(n.... |
2 | 4ZT4 | - | 4RO | C16 H15 Cl2 F2 N5 | c1cc2c(nc1.... |
3 | 4MW1 | - | 44F | C16 H20 Cl N3 O2 S | COc1cc(cc(.... |
4 | 4MWE | - | 2EN | C21 H26 Cl N3 O2 S | C=CCc1cc(c.... |
5 | 4ZT5 | - | 4RN | C17 H19 Cl2 N5 | C[C@@H](CN.... |
6 | 4ZT7 | - | 4RC | C18 H19 Cl2 F N6 | c1cc(nc2c1.... |
7 | 4MVY | - | 387 | C17 H19 Cl2 N3 O2 | c1cc(cc(c1.... |
8 | 5J59 | ic50 < 50 nM | N93 | C16 H16 Cl3 N5 | CN(CCNCc1c.... |
9 | 4MWB | - | 2EK | C13 H15 Cl2 N3 O S2 | c1cscc1NC(.... |
10 | 5V49 | ic50 < 50 nM | 8WA | C18 H19 Cl3 N6 | CN(CCN[C@@.... |
11 | 4MW0 | - | 392 | C17 H19 Cl2 N3 O2 | c1ccc(c(c1.... |
12 | 4MW5 | - | 415 | C18 H22 Cl N3 O2 | COc1cc(cc(.... |
13 | 4ZT6 | - | 4RD | C18 H18 Cl2 F N5 O | c1cc(nc2c1.... |
14 | 4MW4 | - | MET | C5 H11 N O2 S | CSCC[C@@H].... |
15 | 4MW2 | - | MET | C5 H11 N O2 S | CSCC[C@@H].... |
16 | 4MWD | - | ACP | C11 H18 N5 O12 P3 | c1nc(c2c(n.... |
17 | 6SWX | ic50 = 2.06 uM | LWN | C15 H14 F2 N6 O2 | Cn1c2c(cn1.... |
18 | 3KFL | - | ME8 | C15 H23 N6 O8 P S | CSCC[C@@H].... |
19 | 5K0S | ic50 = 0.006 uM | 0OU | C19 H19 Cl2 N3 O | c1ccc2c(c1.... |
20 | 4PY2 | ic50 = 0.272 uM | 43E | C15 H17 Cl2 N3 O S | c1cscc1NC(.... |
21 | 5XET | - | ME8 | C15 H23 N6 O8 P S | CSCC[C@@H].... |
This union binding pocket(no: 1) in the query (biounit: 5v49.bio1) has 15 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |
This union binding pocket(no: 2) in the query (biounit: 5v49.bio2) has 34 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |