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- Structure Biounit | Ligand Information
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No: | PDB id | Binding Data | Representative ligand | Formula | Smiles |
---|---|---|---|---|---|
The Class containing this family consists of a total of 1 families. | |||||
1 | 3V99 | - | ACD | C20 H32 O2 | CCCCCC=C/C.... |
No: | PDB id | Binding Data | Representative ligand | Formula | Smiles |
---|---|---|---|---|---|
The Class containing this family consists of a total of 1 families. | |||||
1 | 3FG4 | - | ACD | C20 H32 O2 | CCCCCC=C/C.... |
2 | 4QWT | - | ACD | C20 H32 O2 | CCCCCC=C/C.... |
3 | 2P0M | - | RS7 | C17 H20 O2 | CCCCCCC#Cc.... |
4 | 1LOX | Ki = 3 uM | RS7 | C17 H20 O2 | CCCCCCC#Cc.... |
5 | 3RDE | - | OYP | C23 H34 O3 | CCCCCCCCCC.... |
6 | 3V99 | - | ACD | C20 H32 O2 | CCCCCC=C/C.... |
No: | Ligand | ECFP6 Tc | MDL keys Tc |
---|---|---|---|
1 | ACD | 1 | 1 |
2 | EPA | 0.725 | 0.869565 |
3 | EIC | 0.714286 | 1 |
4 | LM8 | 0.68 | 0.958333 |
5 | OCR | 0.584906 | 0.884615 |
6 | LNL | 0.574468 | 0.913043 |
7 | 1AG | 0.54717 | 0.647059 |
8 | EAH | 0.491525 | 0.884615 |
9 | ELA | 0.488889 | 0.956522 |
10 | VCA | 0.488889 | 0.956522 |
11 | NER | 0.488889 | 0.956522 |
12 | PAM | 0.488889 | 0.956522 |
13 | OLA | 0.488889 | 0.956522 |
14 | HXA | 0.466667 | 0.782609 |
15 | MYZ | 0.466667 | 0.913043 |
16 | DJ3 | 0.460317 | 0.741935 |
17 | ODD | 0.458333 | 1 |
18 | PTG | 0.411765 | 0.69697 |
19 | 6NA | 0.410256 | 0.826087 |
20 | LEA | 0.405405 | 0.73913 |
21 | SHV | 0.4 | 0.869565 |
No: | Ligand | Similarity coefficient |
---|---|---|
1 | STE | 0.8862 |
This union binding pocket(no: 1) in the query (biounit: 3v99.bio1) has 8 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |