MMsInc Molecule/ Ligand PDB

Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02322396

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
BTP	2-THIOMETHYL-3-PHENYLPROPANOIC ACID	A,B	1JAO	0.73
OBZ	O-benzylhydroxylamine	A,B	3DTH	0.71
OBZ	O-benzylhydroxylamine	A,B	3DTG	0.71
M28	3-[4-(AMINOSULFONYL)PHENYL]PROPANOIC ACID	A,B	2NN1	0.7
M28	3-[4-(AMINOSULFONYL)PHENYL]PROPANOIC ACID	A	2NNO	0.7
PMS	BENZYLSULFINIC ACID	B	1PNM	0.81
PMS	BENZYLSULFINIC ACID	A,B	1SH7	0.81
PMS	BENZYLSULFINIC ACID	B,C	1BB0	0.81
PMS	BENZYLSULFINIC ACID	A,B	1S2N	0.81
PMS	BENZYLSULFINIC ACID	A,B	1WB8	0.81
PMS	BENZYLSULFINIC ACID	A,B,C	3CE4	0.81
PMS	BENZYLSULFINIC ACID	A,B	1Y9Z	0.81
PMS	BENZYLSULFINIC ACID	A	3H18	0.81
PMS	BENZYLSULFINIC ACID	A	3H17	0.81
PMS	BENZYLSULFINIC ACID	A	2CBG	0.81
PMS	BENZYLSULFINIC ACID	A	1SUP	0.81
PMS	BENZYLSULFINIC ACID	A,B	1V6C	0.81
PMS	BENZYLSULFINIC ACID	A,B	1WPR	0.81
PMS	BENZYLSULFINIC ACID	A,B	1EQ9	0.81
PMS	BENZYLSULFINIC ACID	A,B	1AUR	0.81
PMS	BENZYLSULFINIC ACID	A	1KLT	0.81
PMS	BENZYLSULFINIC ACID	B,C	1CA8	0.81
PMS	BENZYLSULFINIC ACID	A	2GKO	0.81
PMS	BENZYLSULFINIC ACID	B,C,D	1BA8	0.81
M5P	(S)-2-(MERCAPTOMETHYL)-5-PHENYLPENTANOIC ACID	A,B	2YZ3	0.72
ISA	3-(4-IODO-PHENYL)-2-MERCAPTO-PROPIONIC ACID	A	1NX3	0.72
ISA	3-(4-IODO-PHENYL)-2-MERCAPTO-PROPIONIC ACID	A,B	1ALW	0.72
B69		A	2ZCR	0.71
PTF	[(METHYLSULFANYL)METHYL]BENZENE	C,F	1RHQ	0.72
256	PHENYL(SULFO)ACETIC ACID	A	1O4Q	0.76
BBS	4-TERT-BUTYLBENZENESULFONIC ACID	B	1EOJ	0.72
BBS	4-TERT-BUTYLBENZENESULFONIC ACID	B	1EOL	0.72
PPP	3-PHENYL-1,2-PROPANDIOL	A,B	1HRN	0.74
BPS		A,B	2DE4	0.71
2HR	HEXYLPHOSPHONIC ACID (R)-2-METHYL- 3-PHENYLPROPYL ESTER	X	1YS1	0.71
PBA	PHENYLETHANE BORONIC ACID	C,G	6CHA	0.72
2HS	HEXYLPHOSPHONIC ACID (S)-2-METHYL- 3-PHENYLPROPYL ESTER	X	1YS2	0.71
MAJ	indane-5-sulfonamide	A	2QOA	0.71
PEL	2-PHENYL-ETHANOL	A,B	1I0D	0.77
PEL	2-PHENYL-ETHANOL	D,H	2I0T	0.77
PEL	2-PHENYL-ETHANOL	A,B	1HZY	0.77
PEL	2-PHENYL-ETHANOL	A,B	1I0B	0.77
PEL	2-PHENYL-ETHANOL	A	1EYW	0.77
PEL	2-PHENYL-ETHANOL	A,B	1JGM	0.77
TOS	P-SULFINOTOLUENE	H	1ETT	0.72
TOS	P-SULFINOTOLUENE	I	4PAD	0.72
TOS	P-SULFINOTOLUENE	A	1EST	0.72
TOS	P-SULFINOTOLUENE	C,G	2CHA	0.72
TOS	P-SULFINOTOLUENE	E	1PPH	0.72
B70	tripotassium (1R)-4-biphenyl-4- yl-1-phosphonatobutane-1-sulfonate	A	2ZCS	0.71
4FA	4-FLUOROPHENETHYL ALCOHOL	A	1OWZ	0.74
M29	ETHYL 3-[4-(AMINOSULFONYL)PHENYL]PROPANOATE	A	2NNV	0.72
M29	ETHYL 3-[4-(AMINOSULFONYL)PHENYL]PROPANOATE	A,B	2NN7	0.72
TSU	PARA-TOLUENE SULFONATE	A,B	1WUW	0.73
TSU	PARA-TOLUENE SULFONATE	A	1B0D	0.73