Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02633403
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 |
NE2![]() | 3,3',4',5-TETRACHLOROBIPHENYL-4- OL | A,B | 2GAB | 0.72 | ![]() |
NE1![]() | 2',3,3',4',5-PENTACHLOROBIPHENYL- 4-OL | A,B | 2G9K | 0.71 | ![]() |
3CH![]() | 3-CHLOROPHENOL | A | 1LI3 | 0.81 | ![]() |
BTT![]() | BENZENE-1,2,4,5-TETROL | A,B,C,D,E,F, G,H,I,J,K,L | 1TI6 | 0.71 | ![]() |
BTT![]() | BENZENE-1,2,4,5-TETROL | M,N,O,P,Q,R, S,T,U,V,W,X | 1VLF | 0.71 | ![]() |
DCN![]() | DICLOSAN | A,B,C,D | 2PD4 | 0.75 | ![]() |
BP6![]() | 2',6'-DICHLORO-BIPHENYL-2,6-DIOL | A | 1LKD | 0.73 | ![]() |
CAQ![]() | CATECHOL | B | 2BUY | 0.76 | ![]() |
CAQ![]() | CATECHOL | A | 1KND | 0.76 | ![]() |
CAQ![]() | CATECHOL | B | 2BUQ | 0.76 | ![]() |
CAQ![]() | CATECHOL | A,B | 1DLT | 0.76 | ![]() |
CAQ![]() | CATECHOL | A | 1XEP | 0.76 | ![]() |
CAQ![]() | CATECHOL | A | 2PUM | 0.76 | ![]() |
43M![]() | 4-CHLORO-3-METHYLPHENOL | A | 2P7A | 0.72 | ![]() |
3FA![]() | 3-FLUOROBENZENE-1,2-DIOL | A | 2AS4 | 0.74 | ![]() |
TCL![]() | TRICLOSAN | A,B,C,D | 2PD3 | 0.78 | ![]() |
TCL![]() | TRICLOSAN | A,B | 1P45 | 0.78 | ![]() |
TCL![]() | TRICLOSAN | A,B,C,D,E,F | 2B35 | 0.78 | ![]() |
TCL![]() | TRICLOSAN | A,B | 1D8A | 0.78 | ![]() |
TCL![]() | TRICLOSAN | A,B | 1C14 | 0.78 | ![]() |
TCL![]() | TRICLOSAN | A,B,C,D | 2QIO | 0.78 | ![]() |
TCL![]() | TRICLOSAN | A,B | 1NHG | 0.78 | ![]() |
TCL![]() | TRICLOSAN | A | 1D7O | 0.78 | ![]() |
TCL![]() | TRICLOSAN | A,B,C,D | 2O2Y | 0.78 | ![]() |
TCL![]() | TRICLOSAN | A,B | 1UH5 | 0.78 | ![]() |
TCL![]() | TRICLOSAN | A,B | 2O2S | 0.78 | ![]() |
TCL![]() | TRICLOSAN | A,B,C,D | 1QG6 | 0.78 | ![]() |
TCL![]() | TRICLOSAN | A,B,C,D,E,F, G,H | 1QSG | 0.78 | ![]() |
PCI![]() | PENTACHLOROPHENOL | A,B | 2GWH | 0.83 | ![]() |
PCI![]() | PENTACHLOROPHENOL | A,B,C | 1Y5N | 0.83 | ![]() |
PCI![]() | PENTACHLOROPHENOL | A,B,C | 1Y4Z | 0.83 | ![]() |
PCI![]() | PENTACHLOROPHENOL | A,B,C,E,F,G | 2VPY | 0.83 | ![]() |
PYG![]() | BENZENE-1,2,3-TRIOL | A,B,C,D,E,F, G,H,I,J,K,L | 1TI4 | 0.72 | ![]() |
PYG![]() | BENZENE-1,2,3-TRIOL | M,N,O,P,Q,R, S,T,U,V,W,X | 1VLE | 0.72 | ![]() |
BP3![]() | 2'-CHLORO-BIPHENYL-2,3-DIOL | A | 1LGT | 0.71 | ![]() |
PCQ![]() | 3,5,3',5'-TETRACHLORO-BIPHENYL- 4,4'-DIOL | A,B | 1G3M | 0.71 | ![]() |
PCQ![]() | 3,5,3',5'-TETRACHLORO-BIPHENYL- 4,4'-DIOL | A,B | 2G5U | 0.71 | ![]() |
TC7![]() | 2,4,5-trichlorophenol | A | 2VCE | 0.92 | ![]() |
2CH![]() | 2-CHLOROPHENOL | A | 1WBO | 0.83 | ![]() |