MMsInc Molecule/ Ligand PDB

Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03207471

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
GR3	3-ACETOXY-17-(1-FORMYL-5-METHYL- 3-OXO-HEX-4-ENYL)-16-HYDROXY-4,10,13,14- TETRAMETHYL-2,3,4,5,6,9,10,11,12,13,14,15,16,17- TETRADECAHYDRO-1H-CYCLOPENTA[A]PHENANTHRENE- 4-CARBOXYLIC ACID	B,D	1AWH	0.7
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	0.74
DGX	DIGOXIN	B,D	1IGJ	0.74
CBO	CARBENOXOLONE	A,B,C,D	1HDC	0.73
CBO	CARBENOXOLONE	A,B,C,D	2BEL	0.73
TH2	TESTOSTERONE HEMISUCCINATE	A,B	2CBT	0.75
TH2	TESTOSTERONE HEMISUCCINATE	A,B,C,D,E,F	2CBQ	0.75
TH2	TESTOSTERONE HEMISUCCINATE	A	2CBO	0.75
NEX		A,B,C,D,E,F, G,H,I,J	1RWT	0.74
NEX		A,B,C	2BHW	0.74
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	0.74
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	0.74
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	0.74
HCY	(11alpha,14beta)-11,17,21-trihydroxypregn- 4-ene-3,20-dione	A,B	2VDY	0.71
HCY	(11alpha,14beta)-11,17,21-trihydroxypregn- 4-ene-3,20-dione	A	2V95	0.71
FUG	FUMAGILLIN	A,B	3FMQ	0.79
FUG	FUMAGILLIN	A	1BOA	0.79
AUR	AUROVERTIN B	A,B,C,D,E,F	1COW	0.7
XAT		A,B,C,D,E,F, G,H,I,J	1RWT	0.72
XAT		A,B,C	2BHW	0.72
KH1	5-(2-{1-[1-(4-ETHYL-4-HYDROXY-HEXYLOXY)- ETHYL]-7A-METHYL-OCTAHYDRO-INDEN- 4-YLIDENE}-ETHYLIDENE)-4-METHYLENE- CYCLOHEXANE-1,3-DIOL	A	1IE8	0.72
0AS	asiatic acid	A	2QN1	0.72
OBN	OUABAIN	H,L	1IBG	0.77
ZBA	12,13-Epoxytrichothec-9-ene-3,4,8,15- tetrol-4,15-diacetate-8-isovalerate	A	2RKV	0.77
ZBA	12,13-Epoxytrichothec-9-ene-3,4,8,15- tetrol-4,15-diacetate-8-isovalerate	A,B,C,D	2ZBA	0.77
FUA	FUSIDIC ACID	A	1QCA	0.81
FUA	FUSIDIC ACID	A,B,C,D,E,F, G,H,I,J,K,L	1Q23	0.81
FUA	FUSIDIC ACID	A,B	2VUF	0.81
CO1	17-[3-(3,3-DIMETHYL-OXIRANYL)-1- METHYL-PROPYL]-10,13-DIMETHYL-2,3,4,7,8,9,10,11,12,13,14,15,16,17- TETRADECAHYDRO-1H-CYCLOPENTA[A]PHENANTHREN- 3-OL	A,B	1P8D	0.73
PRB	13-ACETYLPHORBOL	A	1PTR	0.7
MRC	MUPIROCIN	A	1JZS	0.73
MRC	MUPIROCIN	A,T	1FFY	0.73
MRC	MUPIROCIN	A	1QU3	0.73
MRC	MUPIROCIN	A,T	1QU2	0.73
SIH	PROGESTERONE-11-ALPHA-OL-HEMISUCCINATE	H	1DBM	0.74
CBW	(3BETA,5BETA,14BETA)-3-HYDROXY- 11-OXOOLEAN-12-EN-29-OIC ACID	A	2W4Q	0.73
DOG	DIGOXIGENIN	A	1LKE	0.85
PID	PERIDININ	A	2C9E	0.84
PID	PERIDININ	M,N,O	1PPR	0.84
DTX	DIGITOXIGENIN	A	1LNM	0.84