MMsInc Molecule/ Ligand PDB

Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02419528

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
803	LOVASTATIN	A,B	1CQP	0.73
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
LVA	(3R,5R)-7-((1R,2R,6S,8R,8AS)-2,6- DIMETHYL-8-{[(2R)-2-METHYLBUTANOYL]OXY}- 1,2,6,7,8,8A-HEXAHYDRONAPHTHALEN- 1-YL)-3,5-DIHYDROXYHEPTANOIC ACID	A,B	1T02	0.75
MVB	(1S,7S,8S,8AR)-1,2,3,7,8,8A-HEXAHYDRO- 7-METHYL-8-[2-[(2R,4R)-TETRAHYDRO- 4-HY DROXY-6-OXO-2H-PYRAN-2-YL]ETHYL]- 1-NAPHTHALENOL	A,B,C	1YA8	0.74
RGC	REIDISPONGIOLIDE C	A	2ASP	0.75
114	COMPACTIN	A,B,C,D	1HW8	0.75
SIH	PROGESTERONE-11-ALPHA-OL-HEMISUCCINATE	H	1DBM	0.71
B2S	(3alpha,7alpha)-3,7,15-trihydroxy- 12,13-epoxytrichothec-9-en-8-one	A	3B2S	0.71
CBO	CARBENOXOLONE	A,B,C,D	1HDC	0.7
CBO	CARBENOXOLONE	A,B,C,D	2BEL	0.7
E4H	(3R,4S,5S,7R,9E,11R,12R)-12-ETHYL- 4-HYDROXY-3,5,7,11-TETRAMETHYLOXACYCLODODEC- 9-ENE-2,8-DIONE	A,B	2HFK	0.71
SIM	SIMVASTATIN	A,B,C,D	1HW9	0.77
GA3	GIBBERELLIN A3	A	2ZSH	0.7
GA3	GIBBERELLIN A3	A,B,C,D,E,F	3ED1	0.7
FUA	FUSIDIC ACID	A	1QCA	0.73
FUA	FUSIDIC ACID	A,B,C,D,E,F, G,H,I,J,K,L	1Q23	0.73
FUA	FUSIDIC ACID	A,B	2VUF	0.73
PID	PERIDININ	A	2C9E	0.7
PID	PERIDININ	M,N,O	1PPR	0.7
FOK	FORSKOLIN	A,C	3C16	0.8
FOK	FORSKOLIN	A,C	1CJU	0.8
FOK	FORSKOLIN	A,C	1TL7	0.8
FOK	FORSKOLIN	A,B	1AB8	0.8
FOK	FORSKOLIN	A,C	3C14	0.8
FOK	FORSKOLIN	A,C	1CJT	0.8
FOK	FORSKOLIN	A,B,C	1CUL	0.8
FOK	FORSKOLIN	A,C	1CJV	0.8
FOK	FORSKOLIN	A,C	3C15	0.8
FOK	FORSKOLIN	A,C	1U0H	0.8
FOK	FORSKOLIN	A,B,C	1CS4	0.8
FOK	FORSKOLIN	A,C	1CJK	0.8
PRB	13-ACETYLPHORBOL	A	1PTR	0.73
SRN	SORANGICIN A	C,D	1YNJ	0.72
FUG	FUMAGILLIN	A,B	3FMQ	0.7
FUG	FUMAGILLIN	A	1BOA	0.7
SCG	METHYL (2S,3R,4S)-2-(BETA-D-GLUCOPYRANOSYLOXY)- 4-(2-OXOETHYL)-3-VINYL-3,4-DIHYDRO- 2H-PYRAN-5-CARBOXYLATE	A,B	2FPC	0.71
TH2	TESTOSTERONE HEMISUCCINATE	A,B	2CBT	0.71
TH2	TESTOSTERONE HEMISUCCINATE	A,B,C,D,E,F	2CBQ	0.71
TH2	TESTOSTERONE HEMISUCCINATE	A	2CBO	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	0.71
MRC	MUPIROCIN	A	1JZS	0.74
MRC	MUPIROCIN	A,T	1FFY	0.74
MRC	MUPIROCIN	A	1QU3	0.74
MRC	MUPIROCIN	A,T	1QU2	0.74