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- Structure Biounit | Ligand Information
- PDB : .ZIP | .CSV
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- 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 | 4A8H | - | PUW | C6 H15 N2 O4 P | C(CCNC(=O).... |
2 | 4A8P | - | PAO | C7 H15 N2 O6 P | C(C[C@@H](.... |
3 | 4A8T | - | PAO | C7 H15 N2 O6 P | C(C[C@@H](.... |
No: | PDB id | Binding Data | Representative ligand | Formula | Smiles |
---|---|---|---|---|---|
The Class containing this family consists of a total of 1 families. | |||||
1 | 4A8H | - | PUW | C6 H15 N2 O4 P | C(CCNC(=O).... |
2 | 4A8P | - | PAO | C7 H15 N2 O6 P | C(C[C@@H](.... |
3 | 4A8T | - | PAO | C7 H15 N2 O6 P | C(C[C@@H](.... |
4 | 2I6U | - | NVA | C5 H11 N O2 | CCC[C@@H](.... |
5 | 1DUV | Kd = 1.6 pM | PSQ | C5 H15 N4 O6 P S | C(C[C@@H](.... |
6 | 1OTH | - | PAO | C7 H15 N2 O6 P | C(C[C@@H](.... |
7 | 1EP9 | - | CP | C H4 N O5 P | C(=O)(N)OP.... |
8 | 1C9Y | - | NVA | C5 H11 N O2 | CCC[C@@H](.... |
No: | Ligand | ECFP6 Tc | MDL keys Tc |
---|---|---|---|
1 | PAO | 1 | 1 |
2 | CIR | 0.571429 | 0.615385 |
3 | PA9 | 0.56 | 0.942308 |
4 | RPI | 0.54 | 0.8 |
5 | PUW | 0.511111 | 0.92 |
6 | 5OY | 0.488372 | 0.74 |
7 | 2JJ | 0.488372 | 0.74 |
8 | EOP | 0.475 | 0.843137 |
9 | PSQ | 0.471698 | 0.714286 |
10 | 2YH | 0.470588 | 0.627451 |
11 | 2YJ | 0.45283 | 0.634615 |
12 | NRG | 0.45283 | 0.634921 |
13 | AS1 | 0.428571 | 0.648148 |
This union binding pocket(no: 1) in the query (biounit: 4a8t.bio1) has 20 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |
This union binding pocket(no: 3) in the query (biounit: 4a8t.bio1) has 20 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |
This union binding pocket(no: 4) in the query (biounit: 4a8t.bio1) has 20 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |
This union binding pocket(no: 5) in the query (biounit: 4a8t.bio1) has 20 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |
This union binding pocket(no: 6) in the query (biounit: 4a8t.bio1) has 20 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |