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No: | PDB id | Binding Data | Representative ligand | Formula | Smiles |
---|---|---|---|---|---|
The Class containing this family consists of a total of 67 families. | |||||
1 | 1I3U | - | RR1 | C19 H16 N8 O10 S3 | c1ccc(c(c1.... |
No: | PDB id | Binding Data | Representative ligand | Formula | Smiles |
---|---|---|---|---|---|
The Class containing this family consists of a total of 45 families. | |||||
1 | 1QD0 | - | RR6 | C35 H25 N9 O22 S6 | c1cc(c(cc1.... |
2 | 6ITP | Kd = 22.4 uM | HCY | C21 H30 O5 | C[C@]12CCC.... |
3 | 6ITQ | Kd = 20.5 uM | HCY | C21 H30 O5 | C[C@]12CCC.... |
4 | 1I3U | - | RR1 | C19 H16 N8 O10 S3 | c1ccc(c(c1.... |
5 | 5VM6 | ic50 = 78 nM | 9EG | C13 H9 Cl3 N2 O | c1cc(ccc1N.... |
6 | 5VM0 | Kd = 1.6 nM | 9EG | C13 H9 Cl3 N2 O | c1cc(ccc1N.... |
7 | 3LN9 | - | FLC | C6 H5 O7 | C(C(=O)[O-.... |
8 | 3QXT | Kd = 6700 nM | MTX | C20 H22 N8 O5 | CN(Cc1cnc2.... |
9 | 3QXV | Kd = 5 nM | MTX | C20 H22 N8 O5 | CN(Cc1cnc2.... |
10 | 2X6M | - | GLY TYR GLN ASP TYR GLU PRO GLU ALA | n/a | n/a |
11 | 5VL2 | Kd = 3.77 nM | 9EG | C13 H9 Cl3 N2 O | c1cc(ccc1N.... |
No: | Ligand | ECFP6 Tc | MDL keys Tc |
---|---|---|---|
1 | RR1 | 1 | 1 |
No: | Ligand | Similarity coefficient |
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This union binding pocket(no: 1) in the query (biounit: 1i3u.bio1) has 18 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |