Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02548396
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 |
HXS | 4-[(1R,2S)-1-ethyl-2-(4-hydroxyphenyl)butyl]phenol | A,B | 3CV6 | 0.71 | |
DES | DIETHYLSTILBESTROL | A,B,C,D | 1S9P | 0.7 | |
DES | DIETHYLSTILBESTROL | A,B | 3ERD | 0.7 | |
DES | DIETHYLSTILBESTROL | A,B | 1TT6 | 0.7 | |
DES | DIETHYLSTILBESTROL | A,B,C,D | 1TZ8 | 0.7 | |
BPZ | 4,4'-cyclohexane-1,1-diyldiphenol | A | 2ZKC | 0.72 | |
SS2 | (1R)-1-PHENYLETHANOL | A | 1ZK0 | 0.71 | |
SS2 | (1R)-1-PHENYLETHANOL | A | 1ZJZ | 0.71 | |
SS2 | (1R)-1-PHENYLETHANOL | A | 1ZJY | 0.71 | |
2NA | naphthalen-2-ylmethanol | A,B,C | 3EE5 | 0.72 | |
BRB | PARA-BROMOBENZYL ALCOHOL | A,B | 1HLD | 0.79 | |
LJ3 | 3,5-dibromobiphenyl-4-ol | A,B | 3CN2 | 0.79 | |
12M | (2-ETHYLPHENYL)METHANOL | A,B | 2F62 | 0.71 | |
24B | (2,4-DIFLUOROPHENYL)METHANOL | A,B | 1QV6 | 0.72 | |
ANF | ANTHRONE | H | 2BJM | 0.71 | |
SS1 | 1-PHENYLETHANOL | H | 1UM5 | 0.71 | |
LJ1 | 2,6-dimethyl-4-[(E)-2-phenylethenyl]phenol | A,B | 3CN0 | 0.7 | |
LJ2 | 2,6-dibromo-4-[(E)-2-phenylethenyl]phenol | A,B | 3CN1 | 0.76 | |
DFB | 2,3-DIFLUOROBENZYL ALCOHOL | A,B | 1QV7 | 0.72 | |
DFB | 2,3-DIFLUOROBENZYL ALCOHOL | A,B,C,D | 1MG0 | 0.72 | |
341 | (3,5-difluorophenyl)methanol | C | 3EON | 0.71 |