MMsInc Molecule/ Ligand PDB

Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02464354

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
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	0.73
114	COMPACTIN	A,B,C,D	1HW8	0.73
AUR	AUROVERTIN B	A,B,C,D,E,F	1COW	0.73
SRN	SORANGICIN A	C,D	1YNJ	0.79
SIH	PROGESTERONE-11-ALPHA-OL-HEMISUCCINATE	H	1DBM	0.71
20E	(2beta,3beta,5beta,22R)-2,3,14,20,22,25- hexahydroxycholest-7-en-6-one	A,D	2R40	0.73
OKA	OKADAIC ACID	A	1JK7	0.73
OKA	OKADAIC ACID	C	2IE4	0.73
OKA	OKADAIC ACID	A	1U32	0.73
SPX	SPHINXOLIDE B	A	2ASO	0.73
E7B		A,B	3E7B	0.75
PRB	13-ACETYLPHORBOL	A	1PTR	0.81
WIN	methyl (5beta,7alpha,9beta,10alpha,11alpha,12alpha,13beta,15alpha)- 15-{[(2E)-3,4-dimethylpent-2-enoyl]oxy}- 3,11,12-trihydroxy-2,16-dioxo-13,20- epoxypicras-3-en-21-oate	0,1,2,3,9,A, B,C,F,H,J,K, L,M,N,O,Q,R, S,T,U,Y,Z	3G71	0.75
MRC	MUPIROCIN	A	1JZS	0.83
MRC	MUPIROCIN	A,T	1FFY	0.83
MRC	MUPIROCIN	A	1QU3	0.83
MRC	MUPIROCIN	A,T	1QU2	0.83
OVA	3,4-DIHYDROXY-2-METHOXY-4-METHYL- 3-[2-METHYL-3-(3-METHYL-BUT-2-ENYL) - OXIRANYL]-CYCLOHEXANONE	A	2GZ5	0.73
OVA	3,4-DIHYDROXY-2-METHOXY-4-METHYL- 3-[2-METHYL-3-(3-METHYL-BUT-2-ENYL) - OXIRANYL]-CYCLOHEXANONE	A	1B59	0.73
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	0.7
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
13T	13-DEOXYTEDANOLIDE	0,1,3,9,A,B, C,H,J,K,L,M, N,O,Q,R,S,T, U,Y,Z	2OTJ	0.77
GR4		H,I	1AWF	0.71
SKM	(3R,4S,5R)-3,4,5-TRIHYDROXYCYCLOHEX- 1-ENE-1-CARBOXYLIC ACID	A,B	2IYR	0.73
SKM	(3R,4S,5R)-3,4,5-TRIHYDROXYCYCLOHEX- 1-ENE-1-CARBOXYLIC ACID	A	3BAF	0.73
SKM	(3R,4S,5R)-3,4,5-TRIHYDROXYCYCLOHEX- 1-ENE-1-CARBOXYLIC ACID	A	3DOO	0.73
SKM	(3R,4S,5R)-3,4,5-TRIHYDROXYCYCLOHEX- 1-ENE-1-CARBOXYLIC ACID	A	1U8A	0.73
SKM	(3R,4S,5R)-3,4,5-TRIHYDROXYCYCLOHEX- 1-ENE-1-CARBOXYLIC ACID	A	1ZUI	0.73
SKM	(3R,4S,5R)-3,4,5-TRIHYDROXYCYCLOHEX- 1-ENE-1-CARBOXYLIC ACID	A,B	2EV9	0.73
SKM	(3R,4S,5R)-3,4,5-TRIHYDROXYCYCLOHEX- 1-ENE-1-CARBOXYLIC ACID	A,B,C,D	2HK9	0.73
SKM	(3R,4S,5R)-3,4,5-TRIHYDROXYCYCLOHEX- 1-ENE-1-CARBOXYLIC ACID	A,B	2D5C	0.73
SKM	(3R,4S,5R)-3,4,5-TRIHYDROXYCYCLOHEX- 1-ENE-1-CARBOXYLIC ACID	A	2IYQ	0.73
SKM	(3R,4S,5R)-3,4,5-TRIHYDROXYCYCLOHEX- 1-ENE-1-CARBOXYLIC ACID	A	2AA9	0.73
SKM	(3R,4S,5R)-3,4,5-TRIHYDROXYCYCLOHEX- 1-ENE-1-CARBOXYLIC ACID	A	1ZYU	0.73
SKM	(3R,4S,5R)-3,4,5-TRIHYDROXYCYCLOHEX- 1-ENE-1-CARBOXYLIC ACID	A	2GPT	0.73
SKM	(3R,4S,5R)-3,4,5-TRIHYDROXYCYCLOHEX- 1-ENE-1-CARBOXYLIC ACID	A	2G1K	0.73
SKM	(3R,4S,5R)-3,4,5-TRIHYDROXYCYCLOHEX- 1-ENE-1-CARBOXYLIC ACID	A	2AAY	0.73
SKM	(3R,4S,5R)-3,4,5-TRIHYDROXYCYCLOHEX- 1-ENE-1-CARBOXYLIC ACID	A	2IYX	0.73
SKM	(3R,4S,5R)-3,4,5-TRIHYDROXYCYCLOHEX- 1-ENE-1-CARBOXYLIC ACID	A	2DFN	0.73
SKM	(3R,4S,5R)-3,4,5-TRIHYDROXYCYCLOHEX- 1-ENE-1-CARBOXYLIC ACID	A	2IYS	0.73
P1A	2,3,14,20,22-PENTAHYDROXYCHOLEST- 7-EN-6-ONE	A,D	1R1K	0.73
P1A	2,3,14,20,22-PENTAHYDROXYCHOLEST- 7-EN-6-ONE	E,U	1Z5X	0.73
P1A	2,3,14,20,22-PENTAHYDROXYCHOLEST- 7-EN-6-ONE	E,F,G,H	2NXX	0.73
8PG	(8S,12S)-15S-HYDROXY-9-OXOPROSTA- 10Z,13E-DIEN-1-OIC ACID	A,B	2G5W	0.72
FUA	FUSIDIC ACID	A	1QCA	0.71
FUA	FUSIDIC ACID	A,B,C,D,E,F, G,H,I,J,K,L	1Q23	0.71
FUA	FUSIDIC ACID	A,B	2VUF	0.71
RGC	REIDISPONGIOLIDE C	A	2ASP	0.82
ZBA	12,13-Epoxytrichothec-9-ene-3,4,8,15- tetrol-4,15-diacetate-8-isovalerate	A	2RKV	0.72
ZBA	12,13-Epoxytrichothec-9-ene-3,4,8,15- tetrol-4,15-diacetate-8-isovalerate	A,B,C,D	2ZBA	0.72
FUG	FUMAGILLIN	A,B	3FMQ	0.74
FUG	FUMAGILLIN	A	1BOA	0.74
B2S	(3alpha,7alpha)-3,7,15-trihydroxy- 12,13-epoxytrichothec-9-en-8-one	A	3B2S	0.78
ENX	ENACYLOXIN IIA	A,B	2BVN	0.72
ENX	ENACYLOXIN IIA	A,B,C,D,E,F	1OB5	0.72
FOK	FORSKOLIN	A,C	3C16	0.71
FOK	FORSKOLIN	A,C	1CJU	0.71
FOK	FORSKOLIN	A,C	1TL7	0.71
FOK	FORSKOLIN	A,B	1AB8	0.71
FOK	FORSKOLIN	A,C	3C14	0.71
FOK	FORSKOLIN	A,C	1CJT	0.71
FOK	FORSKOLIN	A,B,C	1CUL	0.71
FOK	FORSKOLIN	A,C	1CJV	0.71
FOK	FORSKOLIN	A,C	3C15	0.71
FOK	FORSKOLIN	A,C	1U0H	0.71
FOK	FORSKOLIN	A,B,C	1CS4	0.71
FOK	FORSKOLIN	A,C	1CJK	0.71
SIM	SIMVASTATIN	A,B,C,D	1HW9	0.71
PUL		A	2C78	0.75
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	0.77
SXN	Salinixanthin	A,B	3DDL	0.72
TG1		A,B	2AGV	0.82
TG1		A	2ZBF	0.82
TG1		A	2ZBG	0.82
TG1		A,B,C,D	1WPG	0.82
TG1		A	2C8L	0.82
TG1		A	2EAR	0.82
TG1		A,B	1IWO	0.82
TG1		A	2C88	0.82
TG1		A	2DQS	0.82
TG1		A	2C8K	0.82
TG1		A	1XP5	0.82
TG1		A	2EAT	0.82
GMM	GLUCOSE MONOMYCOLATE	A	1UQS	0.7