Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00065010
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 |
FPR | PROPYLBENZENE | C | 1RHK | 0.75 | |
OXE | ORTHO-XYLENE | A,B | 3E0X | 0.73 | |
OXE | ORTHO-XYLENE | A | 188L | 0.73 | |
B2F | PHENYLALANINE BORONIC ACID | A,P | 1GBM | 0.7 | |
B2F | PHENYLALANINE BORONIC ACID | A,P | 1GBD | 0.7 | |
B2F | PHENYLALANINE BORONIC ACID | A,P | 1P06 | 0.7 | |
B2F | PHENYLALANINE BORONIC ACID | A,P | 1GBI | 0.7 | |
B2F | PHENYLALANINE BORONIC ACID | A,P | 8LPR | 0.7 | |
PXY | PARA-XYLENE | A | 187L | 0.77 | |
PXY | PARA-XYLENE | A | 225L | 0.77 | |
FRD | 1-PHENYL-2-AMINOPROPANE | A,C | 2AOI | 0.7 | |
FRD | 1-PHENYL-2-AMINOPROPANE | A,B,C | 2AOF | 0.7 | |
FRD | 1-PHENYL-2-AMINOPROPANE | A,B,C | 2AOJ | 0.7 | |
FRD | 1-PHENYL-2-AMINOPROPANE | A,B,C | 2AOH | 0.7 | |
SB7 | [HYDROXY(3-PHENYLPROPYL)AMINO]METHANOL | A | 2AI7 | 0.72 | |
SB7 | [HYDROXY(3-PHENYLPROPYL)AMINO]METHANOL | A,B,C | 2AI8 | 0.72 | |
PNZ | P-NITRO-BENZYLAMINE | A,D,H | 2HJ4 | 0.74 | |
PNZ | P-NITRO-BENZYLAMINE | A,B | 2C70 | 0.74 | |
XYD | 2,5-DIMETHYLANILINE | A,B,C,D | 1KYA | 0.7 | |
XYD | 2,5-DIMETHYLANILINE | A | 1L4L | 0.7 | |
4NM | 4-NITROPHENYL METHANETHIOL | A,B | 2VO4 | 0.74 | |
2HT | 3-methylbenzonitrile | A,B | 3F88 | 0.7 | |
NBZ | NITROBENZENE | A,B | 2BMQ | 0.71 | |
NBZ | NITROBENZENE | A,B | 3BGU | 0.71 | |
MBN | TOLUENE | A,B | 3D7O | 0.74 | |
MBN | TOLUENE | A,B | 1R1X | 0.74 | |
MBN | TOLUENE | A,B | 1JLX | 0.74 | |
MBN | TOLUENE | A,B,C,D | 3D17 | 0.74 | |
MBN | TOLUENE | A,B | 2VRL | 0.74 | |
MBN | TOLUENE | A,I | 2Z3E | 0.74 | |
MBN | TOLUENE | A,B | 1YZI | 0.74 | |
MBN | TOLUENE | A,B | 2DN1 | 0.74 | |
MBN | TOLUENE | A,B | 3EN1 | 0.74 | |
I4B | ISOBUTYLBENZENE | A | 184L | 0.73 | |
PYL | PHENYLETHANE | C | 1B07 | 0.75 | |
PYL | PHENYLETHANE | A,B | 2VRM | 0.75 | |
PYL | PHENYLETHANE | A | 1NHB | 0.75 | |
N4B | N-BUTYLBENZENE | A | 186L | 0.75 | |
3NT | 3-NITROTOLUENE | A,B | 2BMR | 0.8 | |
3NT | 3-NITROTOLUENE | A,B | 2HMO | 0.8 | |
PO0 | 1-BENZYL-(R)-PROPYLAMINE | A,I | 1LZQ | 0.7 | |
PO0 | 1-BENZYL-(R)-PROPYLAMINE | B,I | 1M0B | 0.7 | |
TNL | 2,4,6-TRINITROTOLUENE | A | 1GVR | 0.73 | |
PBA | PHENYLETHANE BORONIC ACID | C,G | 6CHA | 0.75 |