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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 197 families. | |||||
1 | 2B5S | - | HP6 | C7 H16 | CCCCCCC |
2 | 2ALG | - | HP6 | C7 H16 | CCCCCCC |
3 | 1UVB | - | PAM | C16 H30 O2 | CCCCCCC=C/.... |
4 | 1UVA | - | MYR | C14 H28 O2 | CCCCCCCCCC.... |
5 | 1UVC | - | STE | C18 H36 O2 | CCCCCCCCCC.... |
6 | 1FK1 | - | DAO | C12 H24 O2 | CCCCCCCCCC.... |
7 | 1FK2 | - | MYR | C14 H28 O2 | CCCCCCCCCC.... |
8 | 1FK3 | - | PAM | C16 H30 O2 | CCCCCCC=C/.... |
9 | 1MZM | - | PLM | C16 H32 O2 | CCCCCCCCCC.... |
10 | 1FK4 | - | STE | C18 H36 O2 | CCCCCCCCCC.... |
11 | 1FK0 | - | DKA | C10 H20 O2 | CCCCCCCCCC.... |
12 | 1FK7 | - | RCL | C18 H34 O3 | CCCCCC[C@H.... |
13 | 1FK5 | - | OLA | C18 H34 O2 | CCCCCCCCC=.... |
14 | 1FK6 | - | LNL | C18 H30 O2 | CCC=CCC=CC.... |
15 | 1BWO | - | LPC | C22 H47 N O7 P | CCCCCCCCCC.... |
16 | 1MID | - | LAP | C20 H43 N O7 P | CCCCCCCCCC.... |
No: | PDB id | Binding Data | Representative ligand | Formula | Smiles |
---|---|---|---|---|---|
The Class containing this family consists of a total of 165 families. | |||||
1 | 2B5S | - | HP6 | C7 H16 | CCCCCCC |
2 | 2ALG | - | HP6 | C7 H16 | CCCCCCC |
3 | 1UVB | - | PAM | C16 H30 O2 | CCCCCCC=C/.... |
4 | 1UVA | - | MYR | C14 H28 O2 | CCCCCCCCCC.... |
5 | 1UVC | - | STE | C18 H36 O2 | CCCCCCCCCC.... |
6 | 1FK1 | - | DAO | C12 H24 O2 | CCCCCCCCCC.... |
7 | 1FK2 | - | MYR | C14 H28 O2 | CCCCCCCCCC.... |
8 | 1FK3 | - | PAM | C16 H30 O2 | CCCCCCC=C/.... |
9 | 1MZM | - | PLM | C16 H32 O2 | CCCCCCCCCC.... |
10 | 1FK4 | - | STE | C18 H36 O2 | CCCCCCCCCC.... |
11 | 1FK0 | - | DKA | C10 H20 O2 | CCCCCCCCCC.... |
12 | 1FK7 | - | RCL | C18 H34 O3 | CCCCCC[C@H.... |
13 | 1FK5 | - | OLA | C18 H34 O2 | CCCCCCCCC=.... |
14 | 1FK6 | - | LNL | C18 H30 O2 | CCC=CCC=CC.... |
15 | 6IWP | - | MYR | C14 H28 O2 | CCCCCCCCCC.... |
16 | 5TVI | - | O8N | C28 H58 O | CCCCCCCCCC.... |
17 | 6IWN | - | MYR | C14 H28 O2 | CCCCCCCCCC.... |
18 | 6IWO | - | MYR | C14 H28 O2 | CCCCCCCCCC.... |
19 | 1BWO | - | LPC | C22 H47 N O7 P | CCCCCCCCCC.... |
20 | 1MID | - | LAP | C20 H43 N O7 P | CCCCCCCCCC.... |
No: | Ligand | ECFP6 Tc | MDL keys Tc |
---|---|---|---|
1 | LNL | 1 | 1 |
2 | EIC | 0.767442 | 0.913043 |
3 | EPA | 0.697674 | 0.952381 |
4 | MYZ | 0.627907 | 0.826087 |
5 | NER | 0.613636 | 0.869565 |
6 | PAM | 0.613636 | 0.869565 |
7 | ELA | 0.613636 | 0.869565 |
8 | VCA | 0.613636 | 0.869565 |
9 | OLA | 0.613636 | 0.869565 |
10 | HXA | 0.590909 | 0.857143 |
11 | ACD | 0.574468 | 0.913043 |
12 | 10Y | 0.574074 | 0.724138 |
13 | 10X | 0.574074 | 0.724138 |
14 | ODT | 0.54 | 0.952381 |
15 | ODD | 0.510204 | 0.913043 |
16 | RCL | 0.465517 | 0.769231 |
17 | T25 | 0.459016 | 0.677419 |
18 | T24 | 0.459016 | 0.875 |
19 | LM8 | 0.442623 | 0.875 |
20 | MYR | 0.44186 | 0.826087 |
21 | EW8 | 0.44186 | 0.826087 |
22 | DAO | 0.44186 | 0.826087 |
23 | DCR | 0.44186 | 0.826087 |
24 | F23 | 0.44186 | 0.826087 |
25 | TDA | 0.44186 | 0.826087 |
26 | X90 | 0.44186 | 0.826087 |
27 | STE | 0.44186 | 0.826087 |
28 | DKA | 0.44186 | 0.826087 |
29 | PLM | 0.44186 | 0.826087 |
30 | F15 | 0.44186 | 0.826087 |
31 | 11A | 0.44186 | 0.826087 |
32 | KNA | 0.44186 | 0.826087 |
33 | AZ1 | 0.435897 | 0.708333 |
34 | OCR | 0.419355 | 0.807692 |
35 | OCA | 0.418605 | 0.826087 |
36 | 243 | 0.409836 | 0.807692 |
No: | Ligand | Similarity coefficient |
---|
This union binding pocket(no: 1) in the query (biounit: 1fk5.bio1) has 24 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |