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No: | PDB id | Binding Data | Representative ligand | Formula | Smiles |
---|---|---|---|---|---|
The Class containing this family consists of a total of 10 families. | |||||
1 | 1JIL | ic50 = 4 nM | 485 | C17 H24 N2 O8 | C[C@@H]1[C.... |
No: | PDB id | Binding Data | Representative ligand | Formula | Smiles |
---|---|---|---|---|---|
The Class containing this family consists of a total of 4 families. | |||||
1 | 1WQ4 | - | TYR | C9 H11 N O3 | c1cc(ccc1C.... |
2 | 2YXN | - | AZY | C9 H10 N4 O3 | c1cc(c(cc1.... |
3 | 1WQ3 | - | IYR | C9 H10 I N O3 | c1cc(c(cc1.... |
4 | 1X8X | - | TYR | C9 H11 N O3 | c1cc(ccc1C.... |
5 | 1Y42 | - | TYR | C9 H11 N O3 | c1cc(ccc1C.... |
6 | 6HB7 | - | Y3U | C19 H24 N4 O10 S | CN1C(=O)C=.... |
7 | 6HB6 | - | YSU | C18 H22 N4 O10 S | c1cc(ccc1C.... |
8 | 6HB5 | - | YSC | C18 H23 N5 O9 S | c1cc(ccc1C.... |
9 | 7AP3 | - | RRB | C22 H27 N5 O9 S | c1cc(ccc1C.... |
10 | 6I5Y | - | YSA | C19 H23 N7 O8 S | c1cc(ccc1C.... |
11 | 1JIL | ic50 = 4 nM | 485 | C17 H24 N2 O8 | C[C@@H]1[C.... |
12 | 2PID | - | YSA | C19 H23 N7 O8 S | c1cc(ccc1C.... |
13 | 1TYB | - | TYR | C9 H11 N O3 | c1cc(ccc1C.... |
14 | 4TS1 | Kd = 11.6 uM | TYR | C9 H11 N O3 | c1cc(ccc1C.... |
15 | 1TYD | - | TYR | C9 H11 N O3 | c1cc(ccc1C.... |
No: | Ligand | ECFP6 Tc | MDL keys Tc |
---|---|---|---|
1 | 485 | 1 | 1 |
2 | DTY | 0.442623 | 0.613636 |
3 | TYR | 0.442623 | 0.613636 |
4 | MET ASN TYR ASP ILE | 0.426829 | 0.72 |
5 | TYC | 0.42623 | 0.681818 |
6 | SER LYS TYR GLY LEU GLN ASP | 0.402439 | 0.62963 |
No: | Ligand | Similarity coefficient |
---|
This union binding pocket(no: 1) in the query (biounit: 1jil.bio2) has 22 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |
This union binding pocket(no: 2) in the query (biounit: 1jil.bio2) has 22 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |
This union binding pocket(no: 3) in the query (biounit: 1jil.bio1) has 22 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |
This union binding pocket(no: 4) in the query (biounit: 1jil.bio1) has 22 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |