MMsInc Molecule/ Ligand PDB

Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02847613

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
HBR	R,3-HYDROXYBUTAN-2-ONE	A,B	1P28	0.84
COI	2-OXO-4-METHYLPENTANOIC ACID	A,B	1QS0	0.71
COI	2-OXO-4-METHYLPENTANOIC ACID	A,C	1UMD	0.71
COI	2-OXO-4-METHYLPENTANOIC ACID	A	1DXY	0.71
COI	2-OXO-4-METHYLPENTANOIC ACID	A,B	2HDK	0.71
COI	2-OXO-4-METHYLPENTANOIC ACID	A	1HJF	0.71
KIV	3-METHYL-2-OXOBUTANOIC ACID	A,B	1KTA	0.79
KIV	3-METHYL-2-OXOBUTANOIC ACID	A	1HJG	0.79
KIV	3-METHYL-2-OXOBUTANOIC ACID	A,B	1SR9	0.79
KIV	3-METHYL-2-OXOBUTANOIC ACID	A,B,C,D,E	1O68	0.79
2HA	DIHYDROXYACETONE	A,B,C	3CT4	0.71
2HA	DIHYDROXYACETONE	A,B	1UN9	0.71
2HA	DIHYDROXYACETONE	A	1OJR	0.71
HBS	S,3-HYDROXYBUTAN-2-ONE	A,B	1P28	0.84
BUQ	4-HYDROXY-2-BUTANONE	A,B	1D7J	0.78
1LU	4-METHYL-PENTANOIC ACID-2-OXYL GROUP	E,I	6TMN	0.71
1LU	4-METHYL-PENTANOIC ACID-2-OXYL GROUP	I	1DS2	0.71
KPL	KETOPANTOATE	A,B,C,D,E,F, G,H,I,J	1M3U	0.71
IP3	1-HYDROXY-3-METHYLBUTANE	A,B	1HRN	0.73
IP3	1-HYDROXY-3-METHYLBUTANE	A,B	1BIL	0.73
VAD	DEAMINOHYDROXYVALINE	C	1CWO	0.78