Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00255871
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 |
PVS | (ethenylsulfonyl)benzene | A | 3BLU | 0.73 | |
BTP | 2-THIOMETHYL-3-PHENYLPROPANOIC ACID | A,B | 1JAO | 0.75 | |
CVB | 4-(CARBOXYVIN-2-YL)PHENYLBORONIC ACID | A,B | 1KE0 | 0.77 | |
SEH | S-BENZYL PHENYLACETOTHIOHYDROXIMATE- O-SULFATE | M | 1W9D | 0.73 | |
PBA | PHENYLETHANE BORONIC ACID | C,G | 6CHA | 0.71 | |
PTF | [(METHYLSULFANYL)METHYL]BENZENE | C,F | 1RHQ | 0.77 | |
SEB | O-BENZYLSULFONYL-SERINE | A,B,C,D | 2APJ | 0.74 | |
SEB | O-BENZYLSULFONYL-SERINE | A | 1IAV | 0.74 | |
SEB | O-BENZYLSULFONYL-SERINE | A,B | 1IEC | 0.74 | |
SEB | O-BENZYLSULFONYL-SERINE | A | 1ZIY | 0.74 | |
SEB | O-BENZYLSULFONYL-SERINE | A | 1C9N | 0.74 | |
SEB | O-BENZYLSULFONYL-SERINE | A | 1ZJ4 | 0.74 | |
SEB | O-BENZYLSULFONYL-SERINE | A | 1GGV | 0.74 | |
SEB | O-BENZYLSULFONYL-SERINE | A | 1Q5P | 0.74 | |
SEB | O-BENZYLSULFONYL-SERINE | A | 1PQA | 0.74 | |
SEB | O-BENZYLSULFONYL-SERINE | A | 1ZJ5 | 0.74 | |
SEB | O-BENZYLSULFONYL-SERINE | A | 1C9M | 0.74 | |
M28 | 3-[4-(AMINOSULFONYL)PHENYL]PROPANOIC ACID | A,B | 2NN1 | 0.74 | |
M28 | 3-[4-(AMINOSULFONYL)PHENYL]PROPANOIC ACID | A | 2NNO | 0.74 | |
TCA | PHENYLETHYLENECARBOXYLIC ACID | A | 1BE6 | 0.76 | |
TCA | PHENYLETHYLENECARBOXYLIC ACID | A | 1BE8 | 0.76 | |
TCA | PHENYLETHYLENECARBOXYLIC ACID | A,B,C,D,E,F, G,H | 2O78 | 0.76 | |
TOS | P-SULFINOTOLUENE | H | 1ETT | 0.71 | |
TOS | P-SULFINOTOLUENE | I | 4PAD | 0.71 | |
TOS | P-SULFINOTOLUENE | A | 1EST | 0.71 | |
TOS | P-SULFINOTOLUENE | C,G | 2CHA | 0.71 | |
TOS | P-SULFINOTOLUENE | E | 1PPH | 0.71 | |
M5P | (S)-2-(MERCAPTOMETHYL)-5-PHENYLPENTANOIC ACID | A,B | 2YZ3 | 0.74 | |
CPM | S-(2-CARBOXY-3-PHENYLPROPYL)THIODIIMINE- S-METHANE | A | 1CPS | 0.75 | |
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 | |
TSU | PARA-TOLUENE SULFONATE | A,B | 1WUW | 0.72 | |
TSU | PARA-TOLUENE SULFONATE | A | 1B0D | 0.72 | |
5PV | 5-PHENYLVALERIC ACID | A,B | 2AY9 | 0.71 | |
HZH | 1,1,1-trifluoro-3-[(2-phenylethyl)sulfanyl]propan- 2-one | A,B | 3DEA | 0.77 | |
PBB | S-(4-BROMOBENZYL)CYSTEINE | A,B,C,D | 1AQV | 0.71 | |
PMS | BENZYLSULFINIC ACID | B | 1PNM | 0.78 | |
PMS | BENZYLSULFINIC ACID | A,B | 1SH7 | 0.78 | |
PMS | BENZYLSULFINIC ACID | B,C | 1BB0 | 0.78 | |
PMS | BENZYLSULFINIC ACID | A,B | 1S2N | 0.78 | |
PMS | BENZYLSULFINIC ACID | A,B | 1WB8 | 0.78 | |
PMS | BENZYLSULFINIC ACID | A,B,C | 3CE4 | 0.78 | |
PMS | BENZYLSULFINIC ACID | A,B | 1Y9Z | 0.78 | |
PMS | BENZYLSULFINIC ACID | A | 3H18 | 0.78 | |
PMS | BENZYLSULFINIC ACID | A | 3H17 | 0.78 | |
PMS | BENZYLSULFINIC ACID | A | 2CBG | 0.78 | |
PMS | BENZYLSULFINIC ACID | A | 1SUP | 0.78 | |
PMS | BENZYLSULFINIC ACID | A,B | 1V6C | 0.78 | |
PMS | BENZYLSULFINIC ACID | A,B | 1WPR | 0.78 | |
PMS | BENZYLSULFINIC ACID | A,B | 1EQ9 | 0.78 | |
PMS | BENZYLSULFINIC ACID | A,B | 1AUR | 0.78 | |
PMS | BENZYLSULFINIC ACID | A | 1KLT | 0.78 | |
PMS | BENZYLSULFINIC ACID | B,C | 1CA8 | 0.78 | |
PMS | BENZYLSULFINIC ACID | A | 2GKO | 0.78 | |
PMS | BENZYLSULFINIC ACID | B,C,D | 1BA8 | 0.78 | |
BCS | BENZYLCYSTEINE | A,B,G,H | 10GS | 0.78 | |
BCS | BENZYLCYSTEINE | A | 1EH8 | 0.78 | |
256 | PHENYL(SULFO)ACETIC ACID | A | 1O4Q | 0.78 | |
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 |