MMsInc Molecule/ Ligand PDB

Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00009578

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
TSD	3-TRIMETHYLSILYL-PROPIONATE-2,2,3,3,- D4	A	1TUJ	0.79
BUA	BUTANOIC ACID	A	2CZ0	0.71
BUA	BUTANOIC ACID	A	1P0I	0.71
BUA	BUTANOIC ACID	A,B	2HA7	0.71
BUA	BUTANOIC ACID	A	1UK7	0.71
BUA	BUTANOIC ACID	A	2J4C	0.71
BUA	BUTANOIC ACID	A	1ZRM	0.71
BUA	BUTANOIC ACID	A	3DLT	0.71
BUA	BUTANOIC ACID	A	1UGP	0.71
BUA	BUTANOIC ACID	A,B	2CZ1	0.71
4PA	PROPYL ACETATE	A	1TQH	0.92
4PA	PROPYL ACETATE	A	2O7R	0.92
EEE	ETHYL ACETATE	A	2QFL	0.88
EEE	ETHYL ACETATE	A,B,C	1QFI	0.88
EEE	ETHYL ACETATE	A,B,C	1YAH	0.88
EEE	ETHYL ACETATE	A,B,C	1A7Y	0.88
GBL	GAMMA-BUTYROLACTONE	A,B	2VWD	0.79
GBL	GAMMA-BUTYROLACTONE	A,B	3F66	0.79
GBL	GAMMA-BUTYROLACTONE	A	2WD1	0.79
GBL	GAMMA-BUTYROLACTONE	A,B	2CBI	0.79
CA1	ETHYL PROPIONATE	B	2B0F	0.96