MMsInc Molecule/ Ligand PDB

Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs01087987

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
4HG	N-[(4-HYDROXY-8-IODOISOQUINOLIN- 3-YL)CARBONYL]GLYCINE	A	2G19	0.75
4HG	N-[(4-HYDROXY-8-IODOISOQUINOLIN- 3-YL)CARBONYL]GLYCINE	A	2G1M	0.75
6PC	PYRIDINE-2-CARBOXYLIC ACID	A	2OLN	0.74
6PC	PYRIDINE-2-CARBOXYLIC ACID	A	2OLO	0.74
QUI	2-CARBOXYQUINOXALINE	A	1PFE	0.76
QUI	2-CARBOXYQUINOXALINE	A,B	2DA8	0.76
QUI	2-CARBOXYQUINOXALINE	A,C,E,G	2ADW	0.76
QUI	2-CARBOXYQUINOXALINE	A	1VS2	0.76
QUI	2-CARBOXYQUINOXALINE	A	1XVN	0.76
QUI	2-CARBOXYQUINOXALINE	A,B	185D	0.76
QUI	2-CARBOXYQUINOXALINE	A	1XVK	0.76
QUI	2-CARBOXYQUINOXALINE	A,C	1XVR	0.76
QUI	2-CARBOXYQUINOXALINE	A,B	3GO3	0.76
PPD	2-[(3-HYDROXY-2-METHYL-5-PHOSPHONOOXYMETHYL- PYRIDIN-4-YLMETHYLENE)-AMINO]-SUCCINIC ACID	A	1AKB	0.71
PPD	2-[(3-HYDROXY-2-METHYL-5-PHOSPHONOOXYMETHYL- PYRIDIN-4-YLMETHYLENE)-AMINO]-SUCCINIC ACID	A,B	1ARG	0.71
PPD	2-[(3-HYDROXY-2-METHYL-5-PHOSPHONOOXYMETHYL- PYRIDIN-4-YLMETHYLENE)-AMINO]-SUCCINIC ACID	A,B	1ARH	0.71
VRS	VIRGINIAMYCIN S1	0,1,2,3,9,A, B,C,H,J,K,L, M,N,O,Q,R,S, T,U,Y,Z	1YIT	0.73
R69	N-[4-({4-[5-(DIMETHYLAMINO)-2-HYDROXYBENZOYL]BENZOYL}AMINO)AZEPAN- 3-YL]ISONICOTINAMIDE	A	1XH4	0.72
R69	N-[4-({4-[5-(DIMETHYLAMINO)-2-HYDROXYBENZOYL]BENZOYL}AMINO)AZEPAN- 3-YL]ISONICOTINAMIDE	A	1XH9	0.72
PXG	3-[O-PHOSPHONOPYRIDOXYL]--AMINO- BENZOIC ACID	A	1B9I	0.73
R94	N-(4-{[4-(2-HYDROXY-5-PIPERIDIN- 1-YLBENZOYL)BENZOYL]AMINO}AZEPAN- 3-YL)ISONICOTINAMIDE	A	1XH6	0.71
NTM	QUINOLINIC ACID	A	3C2O	0.73
NTM	QUINOLINIC ACID	A,B	1QAP	0.73
NTM	QUINOLINIC ACID	A,B,C,D,E,F	1QPQ	0.73
NTM	QUINOLINIC ACID	A,B,C	2B7N	0.73
PYB	4-AMINO-(1-METHYLPYRROLE)-2-CARBOXYLIC ACID	A,D,E,G,I,J	1S32	0.73
PYB	4-AMINO-(1-METHYLPYRROLE)-2-CARBOXYLIC ACID	D,I,J	1M18	0.73
PYB	4-AMINO-(1-METHYLPYRROLE)-2-CARBOXYLIC ACID	E,I,J	1M1A	0.73
PYB	4-AMINO-(1-METHYLPYRROLE)-2-CARBOXYLIC ACID	E,I,J	1M19	0.73
BLP	(5-HYDROXY-6-METHYL-4-((2-(2-(2- NITROBENZAMIDO)ACETYL)HYDRAZINYL)METHYL)PYRIDIN- 3-YL)METHYL DIHYDROGEN PHOSPHATE	A,B	2GQN	0.7
PLA	2-[(3-HYDROXY-2-METHYL-5-PHOSPHONOOXYMETHYL- PYRIDIN-4-YLMETHYL)-AMINO]-2-METHYL- SUCCINIC ACID	A,B	1TAS	0.71
PLA	2-[(3-HYDROXY-2-METHYL-5-PHOSPHONOOXYMETHYL- PYRIDIN-4-YLMETHYL)-AMINO]-2-METHYL- SUCCINIC ACID	A,B	1AJS	0.71
PLA	2-[(3-HYDROXY-2-METHYL-5-PHOSPHONOOXYMETHYL- PYRIDIN-4-YLMETHYL)-AMINO]-2-METHYL- SUCCINIC ACID	0,A,B,C,D,E, G,J,K,L,M,N, P,R,V,W	1IZL	0.71
PLA	2-[(3-HYDROXY-2-METHYL-5-PHOSPHONOOXYMETHYL- PYRIDIN-4-YLMETHYL)-AMINO]-2-METHYL- SUCCINIC ACID	A	1AMA	0.71
PLA	2-[(3-HYDROXY-2-METHYL-5-PHOSPHONOOXYMETHYL- PYRIDIN-4-YLMETHYL)-AMINO]-2-METHYL- SUCCINIC ACID	A,B,C,D,F,G, H,I,J,K,L,M, O,P,Q,R	1FE1	0.71
PLA	2-[(3-HYDROXY-2-METHYL-5-PHOSPHONOOXYMETHYL- PYRIDIN-4-YLMETHYL)-AMINO]-2-METHYL- SUCCINIC ACID	A,B	1ASL	0.71
AKP	N-(PYRAZIN-2-YLCARBONYL)LEUCYLISOLEUCYL- N~1~-{1-[2-({1-CARBOXY-2-[4-(PHOSPHONOOXY)PHENYL]ETHYL}AMINO)- 1,1-DIHYDROXY-2-OXOETHYL]BUT-3- ENYL}-3-CYCLOHEXYLALANINAMIDE	A,B	1RGQ	0.75
3HM	5-hydroxy-6-methylpyridine-3-carboxylic acid	A,B	3GMC	0.72
NA4	4-[5-(2-CARBOXY-1-FORMYL-ETHYLCARBAMOYL)- PYRIDIN-3-YL]-BENZOIC ACID	A,C	1RHM	0.71