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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 261 families. | |||||
1 | 3IVM | - | ZPR | C18 H22 N2 O4 | c1ccc(cc1).... |
2 | 3IUQ | - | ZPR | C18 H22 N2 O4 | c1ccc(cc1).... |
No: | PDB id | Binding Data | Representative ligand | Formula | Smiles |
---|---|---|---|---|---|
The Class containing this family consists of a total of 1 families. | |||||
1 | 3IVM | - | ZPR | C18 H22 N2 O4 | c1ccc(cc1).... |
2 | 3IUQ | - | ZPR | C18 H22 N2 O4 | c1ccc(cc1).... |
3 | 2BKL | - | ZAH | C16 H20 N2 O5 | C[C@@H](C(.... |
4 | 3DDU | ic50 = 40 nM | 552 | C19 H17 Cl F N3 O3 | c1cc(ccc1C.... |
5 | 1E8N | - | BE2 GLY PHE GLY PRO PHE GLY PHE ALA | n/a | n/a |
6 | 1O6G | - | GLY SIN PRO | n/a | n/a |
7 | 1E8M | - | P0H | C15 H18 N2 O5 | c1ccc(cc1).... |
8 | 3EQ9 | ic50 = 41 nM | X97 | C28 H32 N4 O4 | c1ccc(cc1).... |
9 | 1UOP | - | GLY PHE GLU PRO | n/a | n/a |
10 | 1O6F | - | GLY SIN PRO | n/a | n/a |
11 | 1UOQ | - | GLU PHE SER PRO | n/a | n/a |
12 | 1UOO | Kd = 0.29 uM | GLY PHE ARG PRO | n/a | n/a |
13 | 4BCD | ic50 = 0.033 uM | TDV | C27 H30 F N5 O2 | c1ccc(cc1).... |
14 | 1H2Z | - | GLY SIN PRO | n/a | n/a |
15 | 1QFM | - | SGL | C3 H8 O3 S | C([C@H](CS.... |
No: | Ligand | ECFP6 Tc | MDL keys Tc |
---|---|---|---|
1 | ZPR | 1 | 1 |
2 | ACE PHE PRO PRO PRO PRO THR | 0.488636 | 0.788462 |
3 | PRO PHQ PHE | 0.487805 | 0.814815 |
4 | ALZ | 0.46988 | 0.762712 |
5 | ALA PRO PRO ALA | 0.450704 | 0.716981 |
6 | PRO PRO PRO PRO PRO PRO PRO PRO PRO | 0.415584 | 0.703704 |
7 | PRO PRO PRO PRO PRO PRO PRO PRO | 0.415584 | 0.703704 |
8 | P0H | 0.414634 | 0.814815 |
This union binding pocket(no: 1) in the query (biounit: 3ivm.bio1) has 23 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |
This union binding pocket(no: 2) in the query (biounit: 3ivm.bio1) has 13 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |