MMsInc Molecule/ Ligand PDB

Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00845646

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
PD2	PYRIDINE-2,4-DICARBOXYLIC ACID	A,B,C	2W2I	0.72
PD2	PYRIDINE-2,4-DICARBOXYLIC ACID	A	2GKL	0.72
PD2	PYRIDINE-2,4-DICARBOXYLIC ACID	A,B	2VD7	0.72
PD2	PYRIDINE-2,4-DICARBOXYLIC ACID	A,B	2JIG	0.72
PQQ	PYRROLOQUINOLINE QUINONE	A,B	1CQ1	0.73
PQQ	PYRROLOQUINOLINE QUINONE	A,B	1OTW	0.73
PQQ	PYRROLOQUINOLINE QUINONE	A,B	1C9U	0.73
PQQ	PYRROLOQUINOLINE QUINONE	A,C	1W6S	0.73
PQQ	PYRROLOQUINOLINE QUINONE	A,B	1FLG	0.73
PQQ	PYRROLOQUINOLINE QUINONE	A	1KV9	0.73
PQQ	PYRROLOQUINOLINE QUINONE	A,C	2AD6	0.73
PQQ	PYRROLOQUINOLINE QUINONE	A,B	1CRU	0.73
PQQ	PYRROLOQUINOLINE QUINONE	A,C	1H4I	0.73
PQQ	PYRROLOQUINOLINE QUINONE	A,C	2AD7	0.73
PQQ	PYRROLOQUINOLINE QUINONE	A,C	2AD8	0.73
PQQ	PYRROLOQUINOLINE QUINONE	A,D,I	2D0V	0.73
PQQ	PYRROLOQUINOLINE QUINONE	A,C	4AAH	0.73
PQQ	PYRROLOQUINOLINE QUINONE	A,C,E,G	1H4J	0.73
PQQ	PYRROLOQUINOLINE QUINONE	A	1KB0	0.73
PQQ	PYRROLOQUINOLINE QUINONE	A	1YIQ	0.73
PQQ	PYRROLOQUINOLINE QUINONE	A,C	1LRW	0.73
PQQ	PYRROLOQUINOLINE QUINONE	A,C	1G72	0.73
225	FELODIPINE	A	2NNJ	0.77
BIN	2,3-DICARBOXY-4-(2-CHLORO-PHENYL)- 1-ETHYL-5-ISOPROPOXYCARBONYL-6- METHYL-PYRIDINIUM	A	1C8L	0.79
BIN	2,3-DICARBOXY-4-(2-CHLORO-PHENYL)- 1-ETHYL-5-ISOPROPOXYCARBONYL-6- METHYL-PYRIDINIUM	A	2AMV	0.79
BIN	2,3-DICARBOXY-4-(2-CHLORO-PHENYL)- 1-ETHYL-5-ISOPROPOXYCARBONYL-6- METHYL-PYRIDINIUM	A	3AMV	0.79
QUA	8-HYDROXY-4-(1-HYDROXYETHYL)QUINOLINE- 2-CARBOXYLIC ACID	C	2JQ7	0.75
QUA	8-HYDROXY-4-(1-HYDROXYETHYL)QUINOLINE- 2-CARBOXYLIC ACID	B	1OLN	0.75
QUA	8-HYDROXY-4-(1-HYDROXYETHYL)QUINOLINE- 2-CARBOXYLIC ACID	A	1E9W	0.75
3HM	5-hydroxy-6-methylpyridine-3-carboxylic acid	A,B	3GMC	0.71
116	7-[4-(4-FLUORO-PHENYL)-5-HYDROXYMETHYL- 2,6-DIISOPROPYL-PYRIDIN-3-YL]-3,5- DIHYDROXY-HEPTANOIC ACID	A,B,C,D	1HWJ	0.71
PDC	PYRIDINE-2,6-DICARBOXYLIC ACID	A	2PC2	0.74
PDC	PYRIDINE-2,6-DICARBOXYLIC ACID	A,B,C,D	1ARZ	0.74
PDC	PYRIDINE-2,6-DICARBOXYLIC ACID	A	2PE7	0.74
PDC	PYRIDINE-2,6-DICARBOXYLIC ACID	A	2PES	0.74
PDC	PYRIDINE-2,6-DICARBOXYLIC ACID	A,B	1C3V	0.74
PDC	PYRIDINE-2,6-DICARBOXYLIC ACID	A,B	1P9L	0.74
QND	QUINALDIC ACID	A,B	1IDA	0.73
NTM	QUINOLINIC ACID	A	3C2O	0.77
NTM	QUINOLINIC ACID	A,B	1QAP	0.77
NTM	QUINOLINIC ACID	A,B,C,D,E,F	1QPQ	0.77
NTM	QUINOLINIC ACID	A,B,C	2B7N	0.77
DPY		A,B	1JES	0.78