MMsInc Molecule/ Ligand PDB

Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00009045

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
SHF	LAEVULINIC ACID	A	1YLV	0.7
SHF	LAEVULINIC ACID	A	1H7N	0.7
KIV	3-METHYL-2-OXOBUTANOIC ACID	A,B	1KTA	0.8
KIV	3-METHYL-2-OXOBUTANOIC ACID	A	1HJG	0.8
KIV	3-METHYL-2-OXOBUTANOIC ACID	A,B	1SR9	0.8
KIV	3-METHYL-2-OXOBUTANOIC ACID	A,B,C,D,E	1O68	0.8
1LU	4-METHYL-PENTANOIC ACID-2-OXYL GROUP	E,I	6TMN	0.76
1LU	4-METHYL-PENTANOIC ACID-2-OXYL GROUP	I	1DS2	0.76
COI	2-OXO-4-METHYLPENTANOIC ACID	A,B	1QS0	0.91
COI	2-OXO-4-METHYLPENTANOIC ACID	A,C	1UMD	0.91
COI	2-OXO-4-METHYLPENTANOIC ACID	A	1DXY	0.91
COI	2-OXO-4-METHYLPENTANOIC ACID	A,B	2HDK	0.91
COI	2-OXO-4-METHYLPENTANOIC ACID	A	1HJF	0.91
4MV	4-METHYL VALERIC ACID	A,B,C	1I1M	0.8
4MV	4-METHYL VALERIC ACID	A,B,C	2EIY	0.8
4MV	4-METHYL VALERIC ACID	A	2ECO	0.8
4MV	4-METHYL VALERIC ACID	A,C,D	1UMC	0.8
4MV	4-METHYL VALERIC ACID	A,B	2COG	0.8
LML	ISOBUTYL MALONIC ACID	A	1BFW	0.7
2PP	2-PROPYL-PENTANOIC ACID	P	1DIT	0.7