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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 1331 families. | |||||
1 | 4KBS | - | PX2 | C27 H52 O8 P | CCCCCCCCCC.... |
2 | 4K85 | - | 1PZ | C30 H60 N O6 P | CCCCCCCCCC.... |
3 | 4K80 | - | 1PW | C20 H40 N O6 P | CCCCCCCCCC.... |
4 | 4K84 | - | 1PX | C34 H68 N O6 P | CCCCCCCCCC.... |
No: | PDB id | Binding Data | Representative ligand | Formula | Smiles |
---|---|---|---|---|---|
The Class containing this family consists of a total of 1144 families. | |||||
1 | 4KBS | - | PX2 | C27 H52 O8 P | CCCCCCCCCC.... |
2 | 4K85 | - | 1PZ | C30 H60 N O6 P | CCCCCCCCCC.... |
3 | 4K80 | - | 1PW | C20 H40 N O6 P | CCCCCCCCCC.... |
4 | 4K84 | - | 1PX | C34 H68 N O6 P | CCCCCCCCCC.... |
No: | Ligand | ECFP6 Tc | MDL keys Tc |
---|---|---|---|
1 | 1PX | 1 | 1 |
2 | 1PZ | 1 | 1 |
3 | 1PW | 0.761905 | 0.980769 |
4 | 3XU | 0.666667 | 0.822581 |
5 | 16C | 0.666667 | 0.722222 |
6 | SPL | 0.666667 | 0.722222 |
7 | 18C | 0.666667 | 0.722222 |
8 | FO4 | 0.64557 | 0.822581 |
9 | 6CM | 0.630769 | 0.722222 |
10 | 03F | 0.546512 | 0.630769 |
11 | S1P | 0.529412 | 0.849057 |
12 | EIS | 0.522222 | 0.675676 |
13 | SLF | 0.522222 | 0.675676 |
14 | 2ED | 0.507463 | 0.703704 |
15 | CIS | 0.505376 | 0.675676 |
16 | BGC 18C GAL | 0.494737 | 0.636364 |
17 | 0SG | 0.484211 | 0.684932 |
18 | NKP | 0.460526 | 0.727273 |
19 | LGN | 0.456311 | 0.636364 |
20 | IGC | 0.456311 | 0.636364 |
21 | D21 | 0.414634 | 0.727273 |
No: | Ligand | Similarity coefficient |
---|
This union binding pocket(no: 1) in the query (biounit: 4kbs.bio2) has 32 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |
This union binding pocket(no: 2) in the query (biounit: 4kbs.bio1) has 35 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |