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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 | 1C80 | - | GTP | C10 H16 N5 O14 P3 | c1nc2c(n1[.... |
2 | 1C81 | - | FDQ | C6 H14 O10 P2 | C([C@@H]1[.... |
3 | 1TIP | - | F6P | C6 H13 O9 P | C([C@@H]1[.... |
No: | PDB id | Binding Data | Representative ligand | Formula | Smiles |
---|---|---|---|---|---|
The Class containing this family consists of a total of 1 families. | |||||
1 | 1C80 | - | GTP | C10 H16 N5 O14 P3 | c1nc2c(n1[.... |
2 | 1C81 | - | FDQ | C6 H14 O10 P2 | C([C@@H]1[.... |
3 | 1TIP | - | F6P | C6 H13 O9 P | C([C@@H]1[.... |
No: | Ligand | ECFP6 Tc | MDL keys Tc |
---|---|---|---|
1 | FDQ | 1 | 1 |
2 | AHG | 0.722222 | 0.97561 |
3 | GRF | 0.55814 | 0.698113 |
4 | RP5 | 0.547619 | 0.860465 |
5 | HSX | 0.547619 | 0.860465 |
6 | ABF | 0.547619 | 0.860465 |
7 | G6P | 0.511111 | 0.777778 |
8 | M6P | 0.511111 | 0.777778 |
9 | BG6 | 0.511111 | 0.777778 |
10 | M6D | 0.511111 | 0.777778 |
11 | A6P | 0.511111 | 0.777778 |
12 | BGP | 0.511111 | 0.777778 |
13 | YO5 | 0.5 | 0.822222 |
14 | GPM | 0.5 | 0.822222 |
15 | RI2 | 0.479167 | 0.904762 |
16 | D6G | 0.479167 | 0.822222 |
17 | 50A | 0.478261 | 0.765957 |
18 | RF5 | 0.478261 | 0.765957 |
19 | GLP | 0.469388 | 0.660377 |
20 | 4R1 | 0.469388 | 0.660377 |
21 | PPC | 0.45283 | 0.909091 |
22 | NNG | 0.45283 | 0.660714 |
23 | G16 | 0.45098 | 0.782609 |
24 | 16G | 0.444444 | 0.631579 |
25 | 4QY | 0.444444 | 0.631579 |
26 | BMX | 0.444444 | 0.631579 |
27 | PRP | 0.425926 | 0.883721 |
28 | N | 0.425532 | 0.952381 |
29 | JVA | 0.408163 | 0.755102 |
30 | FGR | 0.4 | 0.689655 |
This union binding pocket(no: 1) in the query (biounit: 1tip.bio1) has 23 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |
1 | 4IJ6 | SEP | 42.4084 |
2 | 4IJ6 | SEP | 42.4084 |
This union binding pocket(no: 2) in the query (biounit: 1tip.bio1) has 16 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |