MMsInc Molecule/ Ligand PDB

Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02453406

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
SSO	1,4-DIDEOXY-1,4-[[2S,3S)-2,4-DIHYDROXY- 3-(SULFOXY)BUTYL]EPISULFONIUMYLIDENE]- D-ARABINITOL INNER SALT	A	1TQS	0.78
HTG	HEPTYL 1-THIOHEXOPYRANOSIDE	B	2PL7	0.85
HTG	HEPTYL 1-THIOHEXOPYRANOSIDE	F,H	2PL6	0.85
HTG	HEPTYL 1-THIOHEXOPYRANOSIDE	A,B	1U19	0.85
HTG	HEPTYL 1-THIOHEXOPYRANOSIDE	A	2VNJ	0.85
HTG	HEPTYL 1-THIOHEXOPYRANOSIDE	A,B,C,D,E,F, G,H	3EJE	0.85
HTG	HEPTYL 1-THIOHEXOPYRANOSIDE	A,B	2G87	0.85
HTG	HEPTYL 1-THIOHEXOPYRANOSIDE	A,B	2PED	0.85
HTG	HEPTYL 1-THIOHEXOPYRANOSIDE	A	2VNI	0.85
HTG	HEPTYL 1-THIOHEXOPYRANOSIDE	A,B,C,D,E,F, G,H	3EJB	0.85
HTG	HEPTYL 1-THIOHEXOPYRANOSIDE	A	2VNH	0.85
HTG	HEPTYL 1-THIOHEXOPYRANOSIDE	A	2BGI	0.85
HTG	HEPTYL 1-THIOHEXOPYRANOSIDE	A,B,C,D,E,F, G,H	3EJD	0.85
HTG	HEPTYL 1-THIOHEXOPYRANOSIDE	A,B	2HPY	0.85
DP5	1,4-DIMERCAPTO-ALPHA-D-GLUCOPYRANOSYL- (1-4)-S-1,4-DIMERCAPTO-BETA-D-GLUCOPYRANOSYL- (1-4)-S-1,4-DIMERCAPTO-BETA-D-GLUCOPYRANOSE	A,B,C,D	1OVW	0.71
NK1	(1R,5S,6S,7R,8S)-1-THIONIABICYCLO[4.3.0]NONAN- 5,7,8-TRIOL	A	2OW6	0.75
TDG	THIODIGALACTOSIDE	A,B	1PV7	0.77
TDG	THIODIGALACTOSIDE	A,B	1A78	0.77
TDG	THIODIGALACTOSIDE	D,E,F,G,H	1LT5	0.77
TDG	THIODIGALACTOSIDE	A,B,C,D,E	1MUQ	0.77
MA2	4-S-methyl-4-thio-alpha-D-glucopyranose	A	1JFH	0.71
SSG	1,4-DEOXY-1,4-DITHIO-BETA-D-GLUCOPYRANOSE	A	1F9O	0.7
SSG	1,4-DEOXY-1,4-DITHIO-BETA-D-GLUCOPYRANOSE	A	1OCJ	0.7
SSG	1,4-DEOXY-1,4-DITHIO-BETA-D-GLUCOPYRANOSE	A	1UOZ	0.7
SSG	1,4-DEOXY-1,4-DITHIO-BETA-D-GLUCOPYRANOSE	A	1H5V	0.7
SOG	2-HYDROXYMETHYL-6-OCTYLSULFANYL- TETRAHYDRO-PYRAN-3,4,5-TRIOL	A	1J2Z	0.83
SOG	2-HYDROXYMETHYL-6-OCTYLSULFANYL- TETRAHYDRO-PYRAN-3,4,5-TRIOL	A,B	1VA5	0.83
SOG	2-HYDROXYMETHYL-6-OCTYLSULFANYL- TETRAHYDRO-PYRAN-3,4,5-TRIOL	A,B,C,D	2VT4	0.83
BGS	BETA-D-GLUCOPYRANOSYLSULFONYLETHANE	A	2B5Z	0.77
FSA	1-S-(carboxymethyl)-1-thio-beta- D-fructopyranose	A,B	3DJE	0.7
IPT	ISOPROPYL-1-BETA-D-THIOGALACTOSIDE	A,B	1NA0	0.83
IPT	ISOPROPYL-1-BETA-D-THIOGALACTOSIDE	A,B,C,D	1LBH	0.83
IPT	ISOPROPYL-1-BETA-D-THIOGALACTOSIDE	A,B,C,D	1TLF	0.83
IPT	ISOPROPYL-1-BETA-D-THIOGALACTOSIDE	A,B	1NA3	0.83
IPT	ISOPROPYL-1-BETA-D-THIOGALACTOSIDE	A,B,C,D	1PX4	0.83
IPT	ISOPROPYL-1-BETA-D-THIOGALACTOSIDE	A,B,C	1KRU	0.83
IPT	ISOPROPYL-1-BETA-D-THIOGALACTOSIDE	A,B,C,D	3DYO	0.83
IPT	ISOPROPYL-1-BETA-D-THIOGALACTOSIDE	A,B	2P9H	0.83
IPT	ISOPROPYL-1-BETA-D-THIOGALACTOSIDE	A,B,C,D	1JYX	0.83
TCB	THIOCELLOBIOSE	A	2O9R	0.7
TCB	THIOCELLOBIOSE	A	1IEX	0.7
NK2	(1R,6S,7R,8S)-1-THIONIABICYCLO[4.3.0]NONAN- 7,8-DIOL	A	2OW7	0.71
SSD	1,4-DIDEOXY-1,4-[[2R,3R)-2,4-DIHYDROXY- 3-(SULFOXY)BUTYL]EPISULFONIUMYLIDENE]- D-ARABINITOL INNER SALT	A	1TQT	0.78
MA1	1,4-dithio-alpha-D-glucopyranose	A	1JFH	0.7
GLT	5-DEOXY-5-THIO-ALPHA-D-GLUCOSE	A,B	1XLI	0.82