Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02355062
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 |
BTP | 2-THIOMETHYL-3-PHENYLPROPANOIC ACID | A,B | 1JAO | 0.75 | |
4FA | 4-FLUOROPHENETHYL ALCOHOL | A | 1OWZ | 0.79 | |
IOB | 3-IODO-BENZYL ALCOHOL | A,B | 1QK0 | 0.71 | |
PBA | PHENYLETHANE BORONIC ACID | C,G | 6CHA | 0.71 | |
256 | PHENYL(SULFO)ACETIC ACID | A | 1O4Q | 0.81 | |
24B | (2,4-DIFLUOROPHENYL)METHANOL | A,B | 1QV6 | 0.7 | |
M29 | ETHYL 3-[4-(AMINOSULFONYL)PHENYL]PROPANOATE | A | 2NNV | 0.71 | |
M29 | ETHYL 3-[4-(AMINOSULFONYL)PHENYL]PROPANOATE | A,B | 2NN7 | 0.71 | |
M28 | 3-[4-(AMINOSULFONYL)PHENYL]PROPANOIC ACID | A,B | 2NN1 | 0.74 | |
M28 | 3-[4-(AMINOSULFONYL)PHENYL]PROPANOIC ACID | A | 2NNO | 0.74 | |
M5P | (S)-2-(MERCAPTOMETHYL)-5-PHENYLPENTANOIC ACID | A,B | 2YZ3 | 0.74 | |
B70 | tripotassium (1R)-4-biphenyl-4- yl-1-phosphonatobutane-1-sulfonate | A | 2ZCS | 0.7 | |
HCI | HYDROCINNAMIC ACID | A,B | 1BXG | 0.72 | |
HCI | HYDROCINNAMIC ACID | A,B | 1TOG | 0.72 | |
HCI | HYDROCINNAMIC ACID | A,B | 1V2F | 0.72 | |
HCI | HYDROCINNAMIC ACID | A,B | 1AHX | 0.72 | |
HCI | HYDROCINNAMIC ACID | A | 1TOI | 0.72 | |
HCI | HYDROCINNAMIC ACID | A,B | 1AY8 | 0.72 | |
HCI | HYDROCINNAMIC ACID | A | 1TOJ | 0.72 | |
ISA | 3-(4-IODO-PHENYL)-2-MERCAPTO-PROPIONIC ACID | A | 1NX3 | 0.74 | |
ISA | 3-(4-IODO-PHENYL)-2-MERCAPTO-PROPIONIC ACID | A,B | 1ALW | 0.74 | |
12M | (2-ETHYLPHENYL)METHANOL | A,B | 2F62 | 0.74 | |
5PV | 5-PHENYLVALERIC ACID | A,B | 2AY9 | 0.71 | |
PDH | (2S)-2-AMINO-3-PHENYL-1-PROPANOL | A | 1GQ0 | 0.7 | |
BBS | 4-TERT-BUTYLBENZENESULFONIC ACID | B | 1EOJ | 0.71 | |
BBS | 4-TERT-BUTYLBENZENESULFONIC ACID | B | 1EOL | 0.71 | |
DFB | 2,3-DIFLUOROBENZYL ALCOHOL | A,B | 1QV7 | 0.7 | |
DFB | 2,3-DIFLUOROBENZYL ALCOHOL | A,B,C,D | 1MG0 | 0.7 | |
CGT | CARBA-GLUCOTROPAEOLIN | M | 1W9B | 0.72 | |
CLT | 4-PHENYL-BUTANOIC ACID | A | 1THL | 0.71 | |
CLT | 4-PHENYL-BUTANOIC ACID | A,B | 2AY7 | 0.71 | |
CLT | 4-PHENYL-BUTANOIC ACID | E,I | 1TMN | 0.71 | |
BPS | A,B | 2DE4 | 0.7 |