Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02173743
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 |
OXE![]() | ORTHO-XYLENE | A,B | 3E0X | 0.75 | ![]() |
OXE![]() | ORTHO-XYLENE | A | 188L | 0.75 | ![]() |
PXY![]() | PARA-XYLENE | A | 187L | 0.7 | ![]() |
PXY![]() | PARA-XYLENE | A | 225L | 0.7 | ![]() |
FPR![]() | PROPYLBENZENE | C | 1RHK | 0.73 | ![]() |
NPY![]() | NAPHTHALENE | A,B | 1O7G | 0.74 | ![]() |
PBA![]() | PHENYLETHANE BORONIC ACID | C,G | 6CHA | 0.71 | ![]() |
AN3![]() | ANTHRACENE | A,B | 2HMN | 0.71 | ![]() |
AN3![]() | ANTHRACENE | A,B | 2HMM | 0.71 | ![]() |
1PB![]() | 1,4-DIPHENYL-2-BUTENE | A,B | 1OJ9 | 0.71 | ![]() |
BDB![]() | A,B | 1KE3 | 0.72 | ![]() | |
DEN![]() | INDENE | A | 183L | 0.72 | ![]() |
I4B![]() | ISOBUTYLBENZENE | A | 184L | 0.73 | ![]() |
GVQ![]() | (2R)-2-(4-CHLOROPHENYL)-2-PHENYLETHANAMINE | A | 2UW8 | 0.7 | ![]() |
PEY![]() | PHENANTHRENE | A,B | 2HML | 0.71 | ![]() |
PEY![]() | PHENANTHRENE | A,B | 2HMK | 0.71 | ![]() |
PYL![]() | PHENYLETHANE | C | 1B07 | 0.73 | ![]() |
PYL![]() | PHENYLETHANE | A,B | 2VRM | 0.73 | ![]() |
PYL![]() | PHENYLETHANE | A | 1NHB | 0.73 | ![]() |
2HT![]() | 3-methylbenzonitrile | A,B | 3F88 | 0.8 | ![]() |
N4B![]() | N-BUTYLBENZENE | A | 186L | 0.73 | ![]() |