Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03422612
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 |
2HR | HEXYLPHOSPHONIC ACID (R)-2-METHYL- 3-PHENYLPROPYL ESTER | X | 1YS1 | 0.7 | |
2HS | HEXYLPHOSPHONIC ACID (S)-2-METHYL- 3-PHENYLPROPYL ESTER | X | 1YS2 | 0.7 | |
PXY | PARA-XYLENE | A | 187L | 0.72 | |
PXY | PARA-XYLENE | A | 225L | 0.72 | |
PTF | [(METHYLSULFANYL)METHYL]BENZENE | C,F | 1RHQ | 0.72 | |
BBS | 4-TERT-BUTYLBENZENESULFONIC ACID | B | 1EOJ | 0.7 | |
BBS | 4-TERT-BUTYLBENZENESULFONIC ACID | B | 1EOL | 0.7 | |
EBP | DIETHYL 4-METHYLBENZYLPHOSPHONATE | A,B | 1DPM | 0.78 | |
EBP | DIETHYL 4-METHYLBENZYLPHOSPHONATE | A,B | 1P6B | 0.78 | |
EBP | DIETHYL 4-METHYLBENZYLPHOSPHONATE | A,B | 1PSC | 0.78 | |
EBP | DIETHYL 4-METHYLBENZYLPHOSPHONATE | A,B | 3E3H | 0.78 | |
EBP | DIETHYL 4-METHYLBENZYLPHOSPHONATE | A,B | 1QW7 | 0.78 | |
EBP | DIETHYL 4-METHYLBENZYLPHOSPHONATE | A,B | 1P6C | 0.78 | |
FPR | PROPYLBENZENE | C | 1RHK | 0.72 | |
MBN | TOLUENE | A,B | 3D7O | 0.71 | |
MBN | TOLUENE | A,B | 1R1X | 0.71 | |
MBN | TOLUENE | A,B | 1JLX | 0.71 | |
MBN | TOLUENE | A,B,C,D | 3D17 | 0.71 | |
MBN | TOLUENE | A,B | 2VRL | 0.71 | |
MBN | TOLUENE | A,I | 2Z3E | 0.71 | |
MBN | TOLUENE | A,B | 1YZI | 0.71 | |
MBN | TOLUENE | A,B | 2DN1 | 0.71 | |
MBN | TOLUENE | A,B | 3EN1 | 0.71 | |
TOS | P-SULFINOTOLUENE | H | 1ETT | 0.74 | |
TOS | P-SULFINOTOLUENE | I | 4PAD | 0.74 | |
TOS | P-SULFINOTOLUENE | A | 1EST | 0.74 | |
TOS | P-SULFINOTOLUENE | C,G | 2CHA | 0.74 | |
TOS | P-SULFINOTOLUENE | E | 1PPH | 0.74 | |
N4B | N-BUTYLBENZENE | A | 186L | 0.72 | |
PYL | PHENYLETHANE | C | 1B07 | 0.72 | |
PYL | PHENYLETHANE | A,B | 2VRM | 0.72 | |
PYL | PHENYLETHANE | A | 1NHB | 0.72 | |
TLD | 4-methylbenzene-1,2-dithiol | A | 2Z94 | 0.79 | |
TSU | PARA-TOLUENE SULFONATE | A,B | 1WUW | 0.73 | |
TSU | PARA-TOLUENE SULFONATE | A | 1B0D | 0.73 |