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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 1 families. | |||||
1 | 3MDM | - | FJZ | C15 H24 N4 S | c1c([nH]cn.... |
2 | 4ENH | Ki = 1.7 uM | FVX | C15 H21 F3 N2 O2 | COCCCC/C(=.... |
3 | 2Q9F | Kd = 7 nM | C3S | C27 H46 O4 S | CC(C)CCC[C.... |
4 | 4FIA | Kd = 2.9 uM | 0U9 | C18 H14 F4 N2 O4 S | C[C@@](CS(.... |
5 | 4J14 | Kd = 30 nM | X2N | C37 H42 F2 N8 O4 | CC[C@@H]([.... |
6 | 3MDV | Kd = 4 nM | CL6 | C22 H17 Cl N2 | c1ccc(cc1).... |
7 | 3MDT | Kd = 5 nM | VOR | C16 H14 F3 N5 O | C[C@@H](c1.... |
8 | 3MDR | - | GJZ | C9 H11 N | c1ccc(cc1).... |
No: | PDB id | Binding Data | Representative ligand | Formula | Smiles |
---|---|---|---|---|---|
The Class containing this family consists of a total of 1 families. | |||||
1 | 3MDM | - | FJZ | C15 H24 N4 S | c1c([nH]cn.... |
2 | 4ENH | Ki = 1.7 uM | FVX | C15 H21 F3 N2 O2 | COCCCC/C(=.... |
3 | 2Q9F | Kd = 7 nM | C3S | C27 H46 O4 S | CC(C)CCC[C.... |
4 | 4FIA | Kd = 2.9 uM | 0U9 | C18 H14 F4 N2 O4 S | C[C@@](CS(.... |
5 | 4J14 | Kd = 30 nM | X2N | C37 H42 F2 N8 O4 | CC[C@@H]([.... |
6 | 3MDV | Kd = 4 nM | CL6 | C22 H17 Cl N2 | c1ccc(cc1).... |
7 | 3MDT | Kd = 5 nM | VOR | C16 H14 F3 N5 O | C[C@@H](c1.... |
8 | 3MDR | - | GJZ | C9 H11 N | c1ccc(cc1).... |
No: | Ligand | ECFP6 Tc | MDL keys Tc |
---|---|---|---|
1 | CL6 | 1 | 1 |
No: | Ligand | Similarity coefficient |
---|---|---|
1 | P4P | 0.9087 |
This union binding pocket(no: 1) in the query (biounit: 3mdv.bio1) has 34 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |
This union binding pocket(no: 2) in the query (biounit: 3mdv.bio2) has 17 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |