Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00057687
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 |
2HT![]() | 3-methylbenzonitrile | A,B | 3F88 | 0.84 | ![]() |
I4B![]() | ISOBUTYLBENZENE | A | 184L | 0.72 | ![]() |
PXY![]() | PARA-XYLENE | A | 187L | 0.72 | ![]() |
PXY![]() | PARA-XYLENE | A | 225L | 0.72 | ![]() |
263![]() | 1-(azidomethyl)-3-methylbenzene | X | 2RB2 | 0.7 | ![]() |
FPR![]() | PROPYLBENZENE | C | 1RHK | 0.72 | ![]() |
267![]() | 1-(azidomethyl)-3-methylbenzene | A | 2RBQ | 0.7 | ![]() |
MBN![]() | TOLUENE | A,B | 3D7O | 0.71 | ![]() |
MBN![]() | TOLUENE | A,B | 1R1X | 0.71 | ![]() |
MBN![]() | TOLUENE | A,B | 1JLX | 0.71 | ![]() |
MBN![]() | TOLUENE | A,B,C,D | 3D17 | 0.71 | ![]() |
MBN![]() | TOLUENE | A,B | 2VRL | 0.71 | ![]() |
MBN![]() | TOLUENE | A,I | 2Z3E | 0.71 | ![]() |
MBN![]() | TOLUENE | A,B | 1YZI | 0.71 | ![]() |
MBN![]() | TOLUENE | A,B | 2DN1 | 0.71 | ![]() |
MBN![]() | TOLUENE | A,B | 3EN1 | 0.71 | ![]() |
1PB![]() | 1,4-DIPHENYL-2-BUTENE | A,B | 1OJ9 | 0.73 | ![]() |
N4B![]() | N-BUTYLBENZENE | A | 186L | 0.72 | ![]() |
PYL![]() | PHENYLETHANE | C | 1B07 | 0.72 | ![]() |
PYL![]() | PHENYLETHANE | A,B | 2VRM | 0.72 | ![]() |
PYL![]() | PHENYLETHANE | A | 1NHB | 0.72 | ![]() |