Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02236850
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 |
DEN | INDENE | A | 183L | 0.73 | |
FPR | PROPYLBENZENE | C | 1RHK | 0.74 | |
BDB | A,B | 1KE3 | 0.77 | ||
I4B | ISOBUTYLBENZENE | A | 184L | 0.74 | |
PBA | PHENYLETHANE BORONIC ACID | C,G | 6CHA | 0.72 | |
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 | |
PXY | PARA-XYLENE | A | 187L | 0.71 | |
PXY | PARA-XYLENE | A | 225L | 0.71 | |
AN3 | ANTHRACENE | A,B | 2HMN | 0.85 | |
AN3 | ANTHRACENE | A,B | 2HMM | 0.85 | |
N4B | N-BUTYLBENZENE | A | 186L | 0.74 | |
260 | 2-(bromomethyl)-1,3-difluorobenzene | X | 2RB0 | 0.75 | |
PEY | PHENANTHRENE | A,B | 2HML | 0.85 | |
PEY | PHENANTHRENE | A,B | 2HMK | 0.85 | |
PYL | PHENYLETHANE | C | 1B07 | 0.74 | |
PYL | PHENYLETHANE | A,B | 2VRM | 0.74 | |
PYL | PHENYLETHANE | A | 1NHB | 0.74 | |
OXE | ORTHO-XYLENE | A,B | 3E0X | 0.76 | |
OXE | ORTHO-XYLENE | A | 188L | 0.76 | |
FNP | {[7-(DIFLUORO-PHOSPHONO-METHYL)- NAPHTHALEN-2-YL]-DIFLUORO-METHYL}- PHOSPHONIC ACID | A | 1KAK | 0.73 | |
NPY | NAPHTHALENE | A,B | 1O7G | 0.87 | |
1PB | 1,4-DIPHENYL-2-BUTENE | A,B | 1OJ9 | 0.77 |