Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00058012
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 |
PXY | PARA-XYLENE | A | 187L | 0.7 | |
PXY | PARA-XYLENE | A | 225L | 0.7 | |
LEG | 1-(4-HEXYLPHENYL)PROP-2-EN-1-ONE | A,B | 2PIN | 0.76 | |
DMW | 2,3-DIMETHYL-1,4-NAPHTHOQUINONE | A,B,C,D,E,F | 2BS4 | 0.72 | |
PBA | PHENYLETHANE BORONIC ACID | C,G | 6CHA | 0.71 | |
FPR | PROPYLBENZENE | C | 1RHK | 0.7 | |
HY1 | PHENYLACETALDEHYDE | D,H | 2I0S | 0.72 | |
HY1 | PHENYLACETALDEHYDE | A,B | 1D6Y | 0.72 | |
HY1 | PHENYLACETALDEHYDE | A,B | 1D6Z | 0.72 | |
HY1 | PHENYLACETALDEHYDE | D,H | 2OK4 | 0.72 | |
HY1 | PHENYLACETALDEHYDE | A,B | 1D6U | 0.72 | |
260 | 2-(bromomethyl)-1,3-difluorobenzene | X | 2RB0 | 0.71 | |
BZQ | DIPHENYLMETHANONE | A,B | 1GT5 | 0.76 | |
BZQ | DIPHENYLMETHANONE | A,B | 1DZP | 0.76 | |
1LP | TRANYLCYPROMINE | A,B | 1OJB | 0.7 | |
I4B | ISOBUTYLBENZENE | A | 184L | 0.71 | |
AC0 | 1-PHENYLETHANONE | A | 1ZK1 | 0.79 | |
AC0 | 1-PHENYLETHANONE | A | 1ZK4 | 0.79 | |
CVB | 4-(CARBOXYVIN-2-YL)PHENYLBORONIC ACID | A,B | 1KE0 | 0.71 | |
HPK | (3E)-2,6-DIOXO-6-PHENYLHEX-3-ENOATE | A | 2PUH | 0.72 | |
PBP | 1-(4-BROMO-PHENYL)-ETHANONE | A,B | 2OK9 | 0.79 | |
PBP | 1-(4-BROMO-PHENYL)-ETHANONE | A,B | 1Z76 | 0.79 | |
PBP | 1-(4-BROMO-PHENYL)-ETHANONE | A | 1BK9 | 0.79 | |
3PL | 3-PHENYLPROPANAL | E | 1Y3G | 0.73 | |
HBX | benzaldehyde | A,B | 3GDN | 0.72 | |
TCA | PHENYLETHYLENECARBOXYLIC ACID | A | 1BE6 | 0.72 | |
TCA | PHENYLETHYLENECARBOXYLIC ACID | A | 1BE8 | 0.72 | |
TCA | PHENYLETHYLENECARBOXYLIC ACID | A,B,C,D,E,F, G,H | 2O78 | 0.72 | |
PYL | PHENYLETHANE | C | 1B07 | 0.7 | |
PYL | PHENYLETHANE | A,B | 2VRM | 0.7 | |
PYL | PHENYLETHANE | A | 1NHB | 0.7 | |
N4B | N-BUTYLBENZENE | A | 186L | 0.7 | |
VK3 | MENADIONE | A | 1TUV | 0.72 | |
VK3 | MENADIONE | A,B | 2QR2 | 0.72 |