Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs01230956
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 |
PMB![]() | PARA-MERCURY-BENZENESULFONIC ACID | B | 1BH9 | 0.71 | ![]() |
PMB![]() | PARA-MERCURY-BENZENESULFONIC ACID | H | 1HDK | 0.71 | ![]() |
PMB![]() | PARA-MERCURY-BENZENESULFONIC ACID | A | 1HJ1 | 0.71 | ![]() |
PMB![]() | PARA-MERCURY-BENZENESULFONIC ACID | A,B,C,D | 1YP2 | 0.71 | ![]() |
PMB![]() | PARA-MERCURY-BENZENESULFONIC ACID | A | 1XZC | 0.71 | ![]() |
NTS![]() | NAPHTHALENE TRISULFONATE | A | 1RML | 0.7 | ![]() |
MAJ![]() | indane-5-sulfonamide | A | 2QOA | 0.74 | ![]() |
TLD![]() | 4-methylbenzene-1,2-dithiol | A | 2Z94 | 0.74 | ![]() |
BZB![]() | BENZO[B]THIOPHENE-2-BORONIC ACID | A,B | 3FKV | 0.7 | ![]() |
BZB![]() | BENZO[B]THIOPHENE-2-BORONIC ACID | A,B | 1C3B | 0.7 | ![]() |
NAS![]() | 2-NAPHTHALENESULFONIC ACID | I | 1QUR | 0.72 | ![]() |
NAS![]() | 2-NAPHTHALENESULFONIC ACID | E,I | 1PPC | 0.72 | ![]() |
NAS![]() | 2-NAPHTHALENESULFONIC ACID | H | 1ETS | 0.72 | ![]() |
FBU![]() | 3,5-DIFLUOROBENZENESULFONAMIDE | A | 1IF6 | 0.73 | ![]() |
FBT![]() | 2,6-DIFLUOROBENZENESULFONAMIDE | A | 1IF5 | 0.73 | ![]() |
BBS![]() | 4-TERT-BUTYLBENZENESULFONIC ACID | B | 1EOJ | 0.78 | ![]() |
BBS![]() | 4-TERT-BUTYLBENZENESULFONIC ACID | B | 1EOL | 0.78 | ![]() |
TSU![]() | PARA-TOLUENE SULFONATE | A,B | 1WUW | 0.82 | ![]() |
TSU![]() | PARA-TOLUENE SULFONATE | A | 1B0D | 0.82 | ![]() |
TOS![]() | P-SULFINOTOLUENE | H | 1ETT | 0.81 | ![]() |
TOS![]() | P-SULFINOTOLUENE | I | 4PAD | 0.81 | ![]() |
TOS![]() | P-SULFINOTOLUENE | A | 1EST | 0.81 | ![]() |
TOS![]() | P-SULFINOTOLUENE | C,G | 2CHA | 0.81 | ![]() |
TOS![]() | P-SULFINOTOLUENE | E | 1PPH | 0.81 | ![]() |
BPS![]() | A,B | 2DE4 | 0.73 | ![]() | |
BIH![]() | NAPHTHALENE-2,6-DISULFONIC ACID | A | 1U4S | 0.7 | ![]() |
AM4![]() | 4-(METHYLSULFONYL)BENZENECARBOXIMIDAMIDE | A | 1TX8 | 0.72 | ![]() |
SML![]() | PHENYL METHYL SULFONE | A,I | 1D6W | 0.8 | ![]() |
SML![]() | PHENYL METHYL SULFONE | A,I | 1D9I | 0.8 | ![]() |
FBS![]() | 4-FLOUROBENZENESULFONAMIDE | A | 1IF4 | 0.73 | ![]() |
PMS![]() | BENZYLSULFINIC ACID | B | 1PNM | 0.73 | ![]() |
PMS![]() | BENZYLSULFINIC ACID | A,B | 1SH7 | 0.73 | ![]() |
PMS![]() | BENZYLSULFINIC ACID | B,C | 1BB0 | 0.73 | ![]() |
PMS![]() | BENZYLSULFINIC ACID | A,B | 1S2N | 0.73 | ![]() |
PMS![]() | BENZYLSULFINIC ACID | A,B | 1WB8 | 0.73 | ![]() |
PMS![]() | BENZYLSULFINIC ACID | A,B,C | 3CE4 | 0.73 | ![]() |
PMS![]() | BENZYLSULFINIC ACID | A,B | 1Y9Z | 0.73 | ![]() |
PMS![]() | BENZYLSULFINIC ACID | A | 3H18 | 0.73 | ![]() |
PMS![]() | BENZYLSULFINIC ACID | A | 3H17 | 0.73 | ![]() |
PMS![]() | BENZYLSULFINIC ACID | A | 2CBG | 0.73 | ![]() |
PMS![]() | BENZYLSULFINIC ACID | A | 1SUP | 0.73 | ![]() |
PMS![]() | BENZYLSULFINIC ACID | A,B | 1V6C | 0.73 | ![]() |
PMS![]() | BENZYLSULFINIC ACID | A,B | 1WPR | 0.73 | ![]() |
PMS![]() | BENZYLSULFINIC ACID | A,B | 1EQ9 | 0.73 | ![]() |
PMS![]() | BENZYLSULFINIC ACID | A,B | 1AUR | 0.73 | ![]() |
PMS![]() | BENZYLSULFINIC ACID | A | 1KLT | 0.73 | ![]() |
PMS![]() | BENZYLSULFINIC ACID | B,C | 1CA8 | 0.73 | ![]() |
PMS![]() | BENZYLSULFINIC ACID | A | 2GKO | 0.73 | ![]() |
PMS![]() | BENZYLSULFINIC ACID | B,C,D | 1BA8 | 0.73 | ![]() |
ZYX![]() | 4-(2-AMINOETHYL)BENZENESULFONAMIDE | A | 2NNG | 0.71 | ![]() |
HZH![]() | 1,1,1-trifluoro-3-[(2-phenylethyl)sulfanyl]propan- 2-one | A,B | 3DEA | 0.75 | ![]() |
PVS![]() | (ethenylsulfonyl)benzene | A | 3BLU | 0.79 | ![]() |
AES![]() | 4-(2-AMINOETHYL)BENZENESULFONYL FLUORIDE | A,B | 3B2Q | 0.75 | ![]() |
AES![]() | 4-(2-AMINOETHYL)BENZENESULFONYL FLUORIDE | O,P,Q,R | 2B4T | 0.75 | ![]() |
AES![]() | 4-(2-AMINOETHYL)BENZENESULFONYL FLUORIDE | O,P,Q,R | 2B4R | 0.75 | ![]() |
AES![]() | 4-(2-AMINOETHYL)BENZENESULFONYL FLUORIDE | A,B | 3EIU | 0.75 | ![]() |
PTF![]() | [(METHYLSULFANYL)METHYL]BENZENE | C,F | 1RHQ | 0.76 | ![]() |
BNS![]() | HYDROSULFONYLBENZENE | 1 | 1YYY | 0.75 | ![]() |
BNS![]() | HYDROSULFONYLBENZENE | A | 1MEM | 0.75 | ![]() |
BNS![]() | HYDROSULFONYLBENZENE | A,D,E | 1FH0 | 0.75 | ![]() |
BNS![]() | HYDROSULFONYLBENZENE | A,B,C,D | 1PQ9 | 0.75 | ![]() |