MMsInc Molecule/ Ligand PDB

Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03129578

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
GC1	2,6-ANHYDRO-L-GULONIC ACID	A	1HUA	0.76
SHB	methyl beta-D-galactopyranuronate	C,D	2NTP	0.85
2OS	3-N-OCTANOYLSUCROSE	A,B	1T3I	0.71
ADA	ALPHA-D-GALACTOPYRANURONIC ACID	C,D	2NST	0.82
ADA	ALPHA-D-GALACTOPYRANURONIC ACID	A	1GXO	0.82
ADA	ALPHA-D-GALACTOPYRANURONIC ACID	A	2EWE	0.82
ADA	ALPHA-D-GALACTOPYRANURONIC ACID	A	2UVH	0.82
ADA	ALPHA-D-GALACTOPYRANURONIC ACID	A	2O04	0.82
ADA	ALPHA-D-GALACTOPYRANURONIC ACID	C,D	2NTB	0.82
ADA	ALPHA-D-GALACTOPYRANURONIC ACID	C,D	2NT9	0.82
ADA	ALPHA-D-GALACTOPYRANURONIC ACID	A	2NZM	0.82
ADA	ALPHA-D-GALACTOPYRANURONIC ACID	A,B	2Z8S	0.82
ADA	ALPHA-D-GALACTOPYRANURONIC ACID	A	2UVJ	0.82
ADA	ALPHA-D-GALACTOPYRANURONIC ACID	A	2O0V	0.82
ADA	ALPHA-D-GALACTOPYRANURONIC ACID	C,D	2NSP	0.82
ADA	ALPHA-D-GALACTOPYRANURONIC ACID	A,B	3B8Y	0.82
ADA	ALPHA-D-GALACTOPYRANURONIC ACID	C,D	2NT6	0.82
ADA	ALPHA-D-GALACTOPYRANURONIC ACID	A	2O17	0.82
ADA	ALPHA-D-GALACTOPYRANURONIC ACID	C,D	2NTP	0.82
ADA	ALPHA-D-GALACTOPYRANURONIC ACID	A	2O1D	0.82
ADA	ALPHA-D-GALACTOPYRANURONIC ACID	C,D	2NTQ	0.82
CS2	D-MANNONIC ACID	A,B,C,D	2QJM	0.75
CS2	D-MANNONIC ACID	A,B	3DBN	0.75
LGU	ALPHA-L-GULURONATE	A	2ZAC	0.82
LGU	ALPHA-L-GULURONATE	A	2ZAA	0.82
LGU	ALPHA-L-GULURONATE	A,B	2QJR	0.82
LGU	ALPHA-L-GULURONATE	A	2ZAB	0.82
LGU	ALPHA-L-GULURONATE	A,B	1J1N	0.82
LGU	ALPHA-L-GULURONATE	A	1Y3P	0.82
149	D-GALCTOPYRANOSYL-1-ON	A,B,C,D	1JZ5	0.77
149	D-GALCTOPYRANOSYL-1-ON	A,B,C,D	3CZJ	0.77
KDF	3-deoxy-alpha-D-erythro-hex-2-ulofuranosonic acid	A,B,C	2VAR	0.82
GU2	2,3-DI-O-METHYL-ALPHA-L-IDOPYRANURONIC ACID	A,B,D,I	2B5T	0.84
GU2	2,3-DI-O-METHYL-ALPHA-L-IDOPYRANURONIC ACID	H,I	1TB6	0.84
3LR	3,6-dideoxy-L-arabino-hexonic acid	A,B	3CXO	0.73
LGC	(3S,4R,5R,6S)-3,4,5-TRIHYDROXY- 6-(HYDROXYMETHYL)TETRAHYDRO-2H- PYRAN-2-ONE	M	1E6X	0.77
LGC	(3S,4R,5R,6S)-3,4,5-TRIHYDROXY- 6-(HYDROXYMETHYL)TETRAHYDRO-2H- PYRAN-2-ONE	A,B	2E40	0.77
LGC	(3S,4R,5R,6S)-3,4,5-TRIHYDROXY- 6-(HYDROXYMETHYL)TETRAHYDRO-2H- PYRAN-2-ONE	A	2VWG	0.77
LGC	(3S,4R,5R,6S)-3,4,5-TRIHYDROXY- 6-(HYDROXYMETHYL)TETRAHYDRO-2H- PYRAN-2-ONE	A,B	3EQO	0.77
KO1	D-glycero-alpha-D-talo-oct-2-ulopyranosonic acid	A,B	2R23	0.73
RSH	3-DEOXY-D-LYXO-HEXONIC ACID	A,B,C,D	1W3T	0.72
LFC	6-DEOXY-L-GALACTONIC ACID	A	2HXU	0.77
GKR	D-GLUCARATE	A	3CXT	0.74
GKR	D-GLUCARATE	A,B	1JCT	0.74
AD0	DIGALACTURONIC ACID	A,B	2UVF	0.79
OSU	N-OCTANOYLSUCROSE	A	1PYY	0.71
GTR	GALACTURONIC ACID	A	1KCD	0.82
GTR	GALACTURONIC ACID	A	1KCC	0.82
GTR	GALACTURONIC ACID	A	1N7Q	0.82
GU1	2,3-DI-O-METHYL-BETA-D-GLUCOPYRANURONIC ACID	H,I	1TB6	0.84
GU1	2,3-DI-O-METHYL-BETA-D-GLUCOPYRANURONIC ACID	A,B,D,I	2B5T	0.84
GC4	4-DEOXY-D-GLUCURONIC ACID	A	1I8Q	0.79
GC4	4-DEOXY-D-GLUCURONIC ACID	A	1C4S	0.79
GC4	4-DEOXY-D-GLUCURONIC ACID	A	1DBO	0.79
GCO	GLUCONIC ACID	B,C,D	1BGG	0.75
GCO	GLUCONIC ACID	A,B	1XLF	0.75
MAV	D-MANNURONIC ACID	A,B	1J1N	0.82
MAV	D-MANNURONIC ACID	A	1Y3P	0.82
MAV	D-MANNURONIC ACID	A,B,D	2PYH	0.82
MAV	D-MANNURONIC ACID	A	1Y3N	0.82
MAV	D-MANNURONIC ACID	A	1HV6	0.82
IDR	L-IDURONIC ACID	A	2V38	0.82
IDR	L-IDURONIC ACID	A	1HM2	0.82
IDR	L-IDURONIC ACID	A	2ERM	0.82
GCW	4-O-METHYL-BETA-D-GLUCURONIC ACID	A	1L8N	0.84
IDU	2-O-sulfo-beta-L-altropyranuronic acid	A,B	2BRS	0.76
IDU	2-O-sulfo-beta-L-altropyranuronic acid	A,B	1FQ9	0.76
GCV	4-O-METHYL-ALPHA-D-GLUCURONIC ACID	A	1K9E	0.84
GCV	4-O-METHYL-ALPHA-D-GLUCURONIC ACID	A,B	1V6X	0.84
GCV	4-O-METHYL-ALPHA-D-GLUCURONIC ACID	A	1UQZ	0.84
GCV	4-O-METHYL-ALPHA-D-GLUCURONIC ACID	A,B	1H41	0.84
GCV	4-O-METHYL-ALPHA-D-GLUCURONIC ACID	A	1K9F	0.84
GCV	4-O-METHYL-ALPHA-D-GLUCURONIC ACID	A,B	1V6W	0.84
KBG	2-KETO-BETA-D-GLUCOSE	A	2F5V	0.75
KBG	2-KETO-BETA-D-GLUCOSE	A	1FQ7	0.75
SSH	3-DEOXY-D-ARABINO-HEXONIC ACID	A,B,C,D	1W3N	0.72
DXG	4-DEOXYGLUCARATE	A,B,C,D	1ECQ	0.75
GLR	2,3-DIHYDROXY-5-OXO-HEXANEDIOATE	A,B,C,D	1EC8	0.7
GLR	2,3-DIHYDROXY-5-OXO-HEXANEDIOATE	A,B,C,D	1JDF	0.7
LGT	L-GLUCARIC ACID	A,B,C,D	3CB3	0.74
LGT	L-GLUCARIC ACID	A,B,C	2PP3	0.74
KDG	2-KETO-3-DEOXYGLUCONATE	A,B	1V1A	0.74
KDG	2-KETO-3-DEOXYGLUCONATE	A,B,C	2VAR	0.74
KDG	2-KETO-3-DEOXYGLUCONATE	A,B,C,D	2QJN	0.74
BDP	BETA-D-GALACTOPYRANURONIC ACID	A	1N7R	0.82
BDP	BETA-D-GALACTOPYRANURONIC ACID	A	3C9E	0.82
BDP	BETA-D-GALACTOPYRANURONIC ACID	A	1LOH	0.82
BDP	BETA-D-GALACTOPYRANURONIC ACID	A	1CAP	0.82
BDP	BETA-D-GALACTOPYRANURONIC ACID	A	1HM3	0.82
BDP	BETA-D-GALACTOPYRANURONIC ACID	A	1HUA	0.82
BDP	BETA-D-GALACTOPYRANURONIC ACID	A	1LXK	0.82
BDP	BETA-D-GALACTOPYRANURONIC ACID	A,B	1GQK	0.82
BDP	BETA-D-GALACTOPYRANURONIC ACID	A,B	1ON8	0.82
BDP	BETA-D-GALACTOPYRANURONIC ACID	P	2BVK	0.82
BDP	BETA-D-GALACTOPYRANURONIC ACID	A	2JCR	0.82
BDP	BETA-D-GALACTOPYRANURONIC ACID	A	1LXM	0.82
BDP	BETA-D-GALACTOPYRANURONIC ACID	A	1HMW	0.82
BDP	BETA-D-GALACTOPYRANURONIC ACID	A	3HYA	0.82
BDP	BETA-D-GALACTOPYRANURONIC ACID	A,B	1GQL	0.82
BDP	BETA-D-GALACTOPYRANURONIC ACID	A	1OFM	0.82
BDP	BETA-D-GALACTOPYRANURONIC ACID	A	1N7Q	0.82
GCU	D-GLUCURONIC ACID	A	1HMW	0.82
GCU	D-GLUCURONIC ACID	A	2JCQ	0.82
GCU	D-GLUCURONIC ACID	A	3HYA	0.82
GCU	D-GLUCURONIC ACID	A,B	2FUQ	0.82
GCU	D-GLUCURONIC ACID	A	1DBG	0.82
GCU	D-GLUCURONIC ACID	A	1FCV	0.82
GCU	D-GLUCURONIC ACID	A	1OFM	0.82
GCU	D-GLUCURONIC ACID	A,B	3E7J	0.82
GCU	D-GLUCURONIC ACID	A	1CB8	0.82
GCU	D-GLUCURONIC ACID	A	1HV6	0.82
GCU	D-GLUCURONIC ACID	A	1HMU	0.82
GCU	D-GLUCURONIC ACID	A,B,C	3E80	0.82
GCU	D-GLUCURONIC ACID	A,B	2VZR	0.82
GCU	D-GLUCURONIC ACID	A	2HYA	0.82
GCU	D-GLUCURONIC ACID	A	1OFL	0.82
GCU	D-GLUCURONIC ACID	A,B	2W87	0.82
GCU	D-GLUCURONIC ACID	A	1MQQ	0.82
GCU	D-GLUCURONIC ACID	A	1HM2	0.82
GCU	D-GLUCURONIC ACID	A	1HYA	0.82
GCU	D-GLUCURONIC ACID	A	2C4S	0.82
GCU	D-GLUCURONIC ACID	A	4HYA	0.82
GCU	D-GLUCURONIC ACID	A	1C4S	0.82
GCU	D-GLUCURONIC ACID	A	1HM3	0.82
GCU	D-GLUCURONIC ACID	A	1DBO	0.82
CKP	(2R,3R,4S,5R)-2,3,4-TRIHYDROXY- 5-[(PHOSPHONATOOXY)METHYL]TETRAHYDROFURAN- 2-CARBOXYLIC ACID	A,B,C,D,E,F, G,H,I,J,K,L	2DCN	0.76
BEM	beta-D-mannuronic acid	A	2ZAA	0.82
BEM	beta-D-mannuronic acid	A	2ZAC	0.82
BEM	beta-D-mannuronic acid	A	2ZAB	0.82
BEM	beta-D-mannuronic acid	A	1Y3N	0.82
BEM	beta-D-mannuronic acid	A	1Y3P	0.82
BEM	beta-D-mannuronic acid	A,B	1J1N	0.82
DSU	((2R,3S,4S,5S)-3,4-DIHYDROXY-5- (HYDROXYMETHYL)-5-((2R,3S,4S,5S,6R)- 3,4,5-TRIHYDROXY-6-METHOXY-TETRAHYDRO- 2H-PYRAN-2-YLOXY)-TETRAHYDROFURAN- 2-YL)METHYL NONANOATE	A,B	2FCT	0.71
DSU	((2R,3S,4S,5S)-3,4-DIHYDROXY-5- (HYDROXYMETHYL)-5-((2R,3S,4S,5S,6R)- 3,4,5-TRIHYDROXY-6-METHOXY-TETRAHYDRO- 2H-PYRAN-2-YLOXY)-TETRAHYDROFURAN- 2-YL)METHYL NONANOATE	A,B	2FCV	0.71
DSU	((2R,3S,4S,5S)-3,4-DIHYDROXY-5- (HYDROXYMETHYL)-5-((2R,3S,4S,5S,6R)- 3,4,5-TRIHYDROXY-6-METHOXY-TETRAHYDRO- 2H-PYRAN-2-YLOXY)-TETRAHYDROFURAN- 2-YL)METHYL NONANOATE	A,B	2FCU	0.71
IDX	2-O-sulfo-alpha-L-gulopyranuronic acid	1	1QQP	0.76
20S	BETA-D-FRUCTOFURANOSYL 6-O-OCTANOYL- ALPHA-D-GLUCOPYRANOSIDE	A,B	2FAF	0.71
20S	BETA-D-FRUCTOFURANOSYL 6-O-OCTANOYL- ALPHA-D-GLUCOPYRANOSIDE	A,B,C,D	2FAH	0.71
20S	BETA-D-FRUCTOFURANOSYL 6-O-OCTANOYL- ALPHA-D-GLUCOPYRANOSIDE	A,B	2QZY	0.71
TGU	TRIGALACTURONIC ACID	A	2V8K	0.75
M8C	METHYL ALPHA-D-GALACTOPYRANURONATE	C,D	2NST	0.85
M8C	METHYL ALPHA-D-GALACTOPYRANURONATE	C,D	2NSP	0.85
M8C	METHYL ALPHA-D-GALACTOPYRANURONATE	C,D	2NT9	0.85
M8C	METHYL ALPHA-D-GALACTOPYRANURONATE	C,D	2NTQ	0.85
M8C	METHYL ALPHA-D-GALACTOPYRANURONATE	C,D	2NTP	0.85
M8C	METHYL ALPHA-D-GALACTOPYRANURONATE	C,D	2NT6	0.85
DG0	4-O-alpha-D-galactopyranuronosyl- alpha-D-galactopyranuronic acid	A	3DYB	0.79
46D	(4AR,6R,7S,8R,8AR)-8-((5R,6R)-3- CARBOXY-TETRAHYDRO-4,5,6-TRIHYDROXY- 2H-PYRAN-2-YLOXY)-HEXAHYDRO-6,7- DIHYDROXY-2-METHYLPYRANO[3,2-D][1,3]DIOXINE- 2-CARBOXYLIC ACID)	A	1X1J	0.76
GCT	4,5-DIHYDROXY-TETRAHYDRO-PYRAN- 2-CARBOXYLIC ACID	A	1RWG	0.73
GCT	4,5-DIHYDROXY-TETRAHYDRO-PYRAN- 2-CARBOXYLIC ACID	A	1RWF	0.73
GCT	4,5-DIHYDROXY-TETRAHYDRO-PYRAN- 2-CARBOXYLIC ACID	A	1RWH	0.73
IDS	O2-SULFO-GLUCURONIC ACID	1	1ZBA	0.76
IDS	O2-SULFO-GLUCURONIC ACID	A	2HYV	0.76
IDS	O2-SULFO-GLUCURONIC ACID	A	1BFC	0.76
IDS	O2-SULFO-GLUCURONIC ACID	A,B,C,D	2VRA	0.76
IDS	O2-SULFO-GLUCURONIC ACID	H,I	3B9F	0.76
IDS	O2-SULFO-GLUCURONIC ACID	B,C,D,E	1E0O	0.76
IDS	O2-SULFO-GLUCURONIC ACID	A	2HYU	0.76
IDS	O2-SULFO-GLUCURONIC ACID	A,B	3DY0	0.76
IDS	O2-SULFO-GLUCURONIC ACID	B	2AXM	0.76
IDS	O2-SULFO-GLUCURONIC ACID	A,B	1FQ9	0.76
IDS	O2-SULFO-GLUCURONIC ACID	A	1BFB	0.76
IDS	O2-SULFO-GLUCURONIC ACID	A,B	1T8U	0.76
IDS	O2-SULFO-GLUCURONIC ACID	A,B	1GMN	0.76
IDS	O2-SULFO-GLUCURONIC ACID	A	1XT3	0.76
IDS	O2-SULFO-GLUCURONIC ACID	A,B,C,D,E,F	1AXM	0.76
IDS	O2-SULFO-GLUCURONIC ACID	A,B,C,D,E,F, G,H	1GMO	0.76
IDS	O2-SULFO-GLUCURONIC ACID	A	2ERM	0.76
IDS	O2-SULFO-GLUCURONIC ACID	B,D,F,H	1XMN	0.76
IDS	O2-SULFO-GLUCURONIC ACID	A	1HPN	0.76
IDS	O2-SULFO-GLUCURONIC ACID	A	1G5N	0.76
IDS	O2-SULFO-GLUCURONIC ACID	1	1QQP	0.76
IDS	O2-SULFO-GLUCURONIC ACID	A,B	1RID	0.76