Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03262967
You can sort the columns by Ligand, Ligand name, PDB and Tanimoto.
You can sort the columns by Ligand, Ligand name, PDB and Tanimoto.
Ligand | Ligand name | Chain | PDB | Tanimoto | Ligand in PDB |
---|---|---|---|---|---|
Ligand | Ligand name | Chain | PDB | Tanimoto | Ligand in PDB |
DME![]() | DECAMETHONIUM ION | A,B,C,D | 1MAA | 0.74 | ![]() |
DME![]() | DECAMETHONIUM ION | A | 1ACL | 0.74 | ![]() |
DIP![]() | DIPENTYLAMINE | C,D | 1A1B | 0.72 | ![]() |
DIP![]() | DIPENTYLAMINE | C,D | 1A07 | 0.72 | ![]() |
DIP![]() | DIPENTYLAMINE | C,D | 1A1A | 0.72 | ![]() |
DIP![]() | DIPENTYLAMINE | C,D | 1A08 | 0.72 | ![]() |
DIP![]() | DIPENTYLAMINE | C,D | 1A09 | 0.72 | ![]() |
2EP![]() | 2-ETHYLPIPERIDINE | H,I | 1A4W | 0.71 | ![]() |
SPJ![]() | (3R,3'R)-N~1~,N~1~'-butane-1,4- diyldibutane-1,3-diamine | A,B | 3BNM | 0.71 | ![]() |
P2Y![]() | (2S)-PYRROLIDIN-2-YLMETHYLAMINE | A,B,C,D | 1ORW | 0.71 | ![]() |
16A![]() | CETYL-TRIMETHYL-AMMONIUM | A | 3HF0 | 0.72 | ![]() |
16A![]() | CETYL-TRIMETHYL-AMMONIUM | A,B,C,D | 1KPG | 0.72 | ![]() |
16A![]() | CETYL-TRIMETHYL-AMMONIUM | A | 1TPY | 0.72 | ![]() |
DRE![]() | N-(6-AMINOHEXYL)HEXANE-1,6-DIAMINE | A,B | 1Z6L | 0.74 | ![]() |
10A![]() | DIDECYL-DIMETHYL-AMMONIUM | A,B,C,D | 1KPH | 0.74 | ![]() |
10A![]() | DIDECYL-DIMETHYL-AMMONIUM | A | 1KPI | 0.74 | ![]() |
SPZ![]() | (3S,3'S)-N~1~,N~1~'-butane-1,4- diyldibutane-1,3-diamine | A,B | 3BNU | 0.71 | ![]() |
CDU![]() | N-CYCLOHEXYL-N'-DECYLUREA | A,B | 1EK2 | 0.7 | ![]() |