MMsInc Molecule/ Ligand PDB

Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00005662

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
3HL	(3S)-3-HYDROXYBUTANOIC ACID	A	2ECQ	0.72
3HL	(3S)-3-HYDROXYBUTANOIC ACID	A,B,C,D	3EEW	0.72
4PA	PROPYL ACETATE	A	1TQH	0.73
4PA	PROPYL ACETATE	A	2O7R	0.73
AAE	ACETOACETIC ACID	A,B,C,D	3EEW	0.76
AAE	ACETOACETIC ACID	A	1FCP	0.76
AAE	ACETOACETIC ACID	A	1UJW	0.76
AAE	ACETOACETIC ACID	A,B	1QCO	0.76
AAE	ACETOACETIC ACID	A,B,C,D,L	1E3W	0.76
AAE	ACETOACETIC ACID	A,B	1YSL	0.76
AAE	ACETOACETIC ACID	A	2FCP	0.76
EEE	ETHYL ACETATE	A	2QFL	0.7
EEE	ETHYL ACETATE	A,B,C	1QFI	0.7
EEE	ETHYL ACETATE	A,B,C	1YAH	0.7
EEE	ETHYL ACETATE	A,B,C	1A7Y	0.7
RB3	(1R)-3-{[(1R)-3-METHOXY-1-METHYL- 3-OXOPROPYL]OXY}-1-METHYL-3-OXOPROPYL (3R)- 3-HYDROXYBUTANOATE	A	2D81	0.72
CA1	ETHYL PROPIONATE	B	2B0F	0.77