MMsInc Molecule/ Ligand PDB

Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03380121

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
ZBA	12,13-Epoxytrichothec-9-ene-3,4,8,15- tetrol-4,15-diacetate-8-isovalerate	A	2RKV	0.71
ZBA	12,13-Epoxytrichothec-9-ene-3,4,8,15- tetrol-4,15-diacetate-8-isovalerate	A,B,C,D	2ZBA	0.71
FUA	FUSIDIC ACID	A	1QCA	0.78
FUA	FUSIDIC ACID	A,B,C,D,E,F, G,H,I,J,K,L	1Q23	0.78
FUA	FUSIDIC ACID	A,B	2VUF	0.78
2OB	CHOLESTERYL OLEATE	A	2OBD	0.71
TES	TESTOSTERONE	A	1JTV	0.7
TES	TESTOSTERONE	A	2Q7L	0.7
TES	TESTOSTERONE	A	2Q7I	0.7
TES	TESTOSTERONE	A,B	1J96	0.7
TES	TESTOSTERONE	A	2Q7K	0.7
TES	TESTOSTERONE	A,B	1Q13	0.7
TES	TESTOSTERONE	H	1I9J	0.7
TES	TESTOSTERONE	A,B	1AFS	0.7
TES	TESTOSTERONE	H	1VPO	0.7
TES	TESTOSTERONE	A	2Q7J	0.7
TES	TESTOSTERONE	A,B	3BUR	0.7
TES	TESTOSTERONE	A	2AM9	0.7
DOG	DIGOXIGENIN	A	1LKE	0.76
CLL	CHOLESTERYL LINOLEATE	A,B	1CLE	0.71
NTH	SUCCINIC ACID MONO-(13-METHYL-3- OXO-2,3,6,7,8,9,10,11,12,13,14,15,16,17- TETRADECAHYDRO-1H-CYCLOPENTA[A]PHENANTHREN- 17-YL) ESTER	A,B	1BUQ	0.77
AFB	1,6,7,8,9,11A,12,13,14,14A-DECAHYDRO- 1,13-DIHYDROXY-6-METHYL-4H-CYCLOPENT[F]OXACYCLOTRIDECIN- 4-ONE	A,B,E	1R8Q	0.73
AFB	1,6,7,8,9,11A,12,13,14,14A-DECAHYDRO- 1,13-DIHYDROXY-6-METHYL-4H-CYCLOPENT[F]OXACYCLOTRIDECIN- 4-ONE	A	1RE0	0.73
AFB	1,6,7,8,9,11A,12,13,14,14A-DECAHYDRO- 1,13-DIHYDROXY-6-METHYL-4H-CYCLOPENT[F]OXACYCLOTRIDECIN- 4-ONE	A,E	1S9D	0.73
DGX	DIGOXIN	B,D	1IGJ	0.7
CBO	CARBENOXOLONE	A,B,C,D	1HDC	0.72
CBO	CARBENOXOLONE	A,B,C,D	2BEL	0.72
FFA	(10ALPHA,13ALPHA,14BETA,17ALPHA)- 17-HYDROXYANDROST-4-EN-3-ONE	A,B	2IPG	0.7
FFA	(10ALPHA,13ALPHA,14BETA,17ALPHA)- 17-HYDROXYANDROST-4-EN-3-ONE	A,B	2IPJ	0.7
FFA	(10ALPHA,13ALPHA,14BETA,17ALPHA)- 17-HYDROXYANDROST-4-EN-3-ONE	A,B	2IPF	0.7
CBW	(3BETA,5BETA,14BETA)-3-HYDROXY- 11-OXOOLEAN-12-EN-29-OIC ACID	A	2W4Q	0.7
DTX	DIGITOXIGENIN	A	1LNM	0.77
TH2	TESTOSTERONE HEMISUCCINATE	A,B	2CBT	0.76
TH2	TESTOSTERONE HEMISUCCINATE	A,B,C,D,E,F	2CBQ	0.76
TH2	TESTOSTERONE HEMISUCCINATE	A	2CBO	0.76
SIH	PROGESTERONE-11-ALPHA-OL-HEMISUCCINATE	H	1DBM	0.74
OBN	OUABAIN	H,L	1IBG	0.73
PID	PERIDININ	A	2C9E	0.74
PID	PERIDININ	M,N,O	1PPR	0.74
FUG	FUMAGILLIN	A,B	3FMQ	0.72
FUG	FUMAGILLIN	A	1BOA	0.72
HCR	7-HYDROXYCHOLESTEROL	A	1ZHT	0.73