Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00012008
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 |
BZB![]() | BENZO[B]THIOPHENE-2-BORONIC ACID | A,B | 3FKV | 0.86 | ![]() |
BZB![]() | BENZO[B]THIOPHENE-2-BORONIC ACID | A,B | 1C3B | 0.86 | ![]() |
PYL![]() | PHENYLETHANE | C | 1B07 | 0.71 | ![]() |
PYL![]() | PHENYLETHANE | A,B | 2VRM | 0.71 | ![]() |
PYL![]() | PHENYLETHANE | A | 1NHB | 0.71 | ![]() |
N4B![]() | N-BUTYLBENZENE | A | 186L | 0.71 | ![]() |
ESX![]() | BENZO[B]THIOPHENE-2-CARBOXAMIDINE | A | 1C5S | 0.71 | ![]() |
PTF![]() | [(METHYLSULFANYL)METHYL]BENZENE | C,F | 1RHQ | 0.8 | ![]() |
TLD![]() | 4-methylbenzene-1,2-dithiol | A | 2Z94 | 0.71 | ![]() |
PVS![]() | (ethenylsulfonyl)benzene | A | 3BLU | 0.71 | ![]() |
HZH![]() | 1,1,1-trifluoro-3-[(2-phenylethyl)sulfanyl]propan- 2-one | A,B | 3DEA | 0.74 | ![]() |
FPR![]() | PROPYLBENZENE | C | 1RHK | 0.71 | ![]() |
IBZ![]() | 2-IODOBENZYLTHIO GROUP | A,B | 1CEL | 0.71 | ![]() |