MMsInc Molecule/ Ligand PDB

Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00321562

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	0.71
GCV	4-O-METHYL-ALPHA-D-GLUCURONIC ACID	A	1K9E	0.78
GCV	4-O-METHYL-ALPHA-D-GLUCURONIC ACID	A,B	1V6X	0.78
GCV	4-O-METHYL-ALPHA-D-GLUCURONIC ACID	A	1UQZ	0.78
GCV	4-O-METHYL-ALPHA-D-GLUCURONIC ACID	A,B	1H41	0.78
GCV	4-O-METHYL-ALPHA-D-GLUCURONIC ACID	A	1K9F	0.78
GCV	4-O-METHYL-ALPHA-D-GLUCURONIC ACID	A,B	1V6W	0.78
BEM	beta-D-mannuronic acid	A	2ZAA	0.77
BEM	beta-D-mannuronic acid	A	2ZAC	0.77
BEM	beta-D-mannuronic acid	A	2ZAB	0.77
BEM	beta-D-mannuronic acid	A	1Y3N	0.77
BEM	beta-D-mannuronic acid	A	1Y3P	0.77
BEM	beta-D-mannuronic acid	A,B	1J1N	0.77
GCW	4-O-METHYL-BETA-D-GLUCURONIC ACID	A	1L8N	0.78
KBG	2-KETO-BETA-D-GLUCOSE	A	2F5V	0.7
KBG	2-KETO-BETA-D-GLUCOSE	A	1FQ7	0.7
AD0	DIGALACTURONIC ACID	A,B	2UVF	0.79
IDS	O2-SULFO-GLUCURONIC ACID	1	1ZBA	0.72
IDS	O2-SULFO-GLUCURONIC ACID	A	2HYV	0.72
IDS	O2-SULFO-GLUCURONIC ACID	A	1BFC	0.72
IDS	O2-SULFO-GLUCURONIC ACID	A,B,C,D	2VRA	0.72
IDS	O2-SULFO-GLUCURONIC ACID	H,I	3B9F	0.72
IDS	O2-SULFO-GLUCURONIC ACID	B,C,D,E	1E0O	0.72
IDS	O2-SULFO-GLUCURONIC ACID	A	2HYU	0.72
IDS	O2-SULFO-GLUCURONIC ACID	A,B	3DY0	0.72
IDS	O2-SULFO-GLUCURONIC ACID	B	2AXM	0.72
IDS	O2-SULFO-GLUCURONIC ACID	A,B	1FQ9	0.72
IDS	O2-SULFO-GLUCURONIC ACID	A	1BFB	0.72
IDS	O2-SULFO-GLUCURONIC ACID	A,B	1T8U	0.72
IDS	O2-SULFO-GLUCURONIC ACID	A,B	1GMN	0.72
IDS	O2-SULFO-GLUCURONIC ACID	A	1XT3	0.72
IDS	O2-SULFO-GLUCURONIC ACID	A,B,C,D,E,F	1AXM	0.72
IDS	O2-SULFO-GLUCURONIC ACID	A,B,C,D,E,F, G,H	1GMO	0.72
IDS	O2-SULFO-GLUCURONIC ACID	A	2ERM	0.72
IDS	O2-SULFO-GLUCURONIC ACID	B,D,F,H	1XMN	0.72
IDS	O2-SULFO-GLUCURONIC ACID	A	1HPN	0.72
IDS	O2-SULFO-GLUCURONIC ACID	A	1G5N	0.72
IDS	O2-SULFO-GLUCURONIC ACID	1	1QQP	0.72
IDS	O2-SULFO-GLUCURONIC ACID	A,B	1RID	0.72
BDP	BETA-D-GALACTOPYRANURONIC ACID	A	1N7R	0.77
BDP	BETA-D-GALACTOPYRANURONIC ACID	A	3C9E	0.77
BDP	BETA-D-GALACTOPYRANURONIC ACID	A	1LOH	0.77
BDP	BETA-D-GALACTOPYRANURONIC ACID	A	1CAP	0.77
BDP	BETA-D-GALACTOPYRANURONIC ACID	A	1HM3	0.77
BDP	BETA-D-GALACTOPYRANURONIC ACID	A	1HUA	0.77
BDP	BETA-D-GALACTOPYRANURONIC ACID	A	1LXK	0.77
BDP	BETA-D-GALACTOPYRANURONIC ACID	A,B	1GQK	0.77
BDP	BETA-D-GALACTOPYRANURONIC ACID	A,B	1ON8	0.77
BDP	BETA-D-GALACTOPYRANURONIC ACID	P	2BVK	0.77
BDP	BETA-D-GALACTOPYRANURONIC ACID	A	2JCR	0.77
BDP	BETA-D-GALACTOPYRANURONIC ACID	A	1LXM	0.77
BDP	BETA-D-GALACTOPYRANURONIC ACID	A	1HMW	0.77
BDP	BETA-D-GALACTOPYRANURONIC ACID	A	3HYA	0.77
BDP	BETA-D-GALACTOPYRANURONIC ACID	A,B	1GQL	0.77
BDP	BETA-D-GALACTOPYRANURONIC ACID	A	1OFM	0.77
BDP	BETA-D-GALACTOPYRANURONIC ACID	A	1N7Q	0.77
GCU	D-GLUCURONIC ACID	A	1HMW	0.77
GCU	D-GLUCURONIC ACID	A	2JCQ	0.77
GCU	D-GLUCURONIC ACID	A	3HYA	0.77
GCU	D-GLUCURONIC ACID	A,B	2FUQ	0.77
GCU	D-GLUCURONIC ACID	A	1DBG	0.77
GCU	D-GLUCURONIC ACID	A	1FCV	0.77
GCU	D-GLUCURONIC ACID	A	1OFM	0.77
GCU	D-GLUCURONIC ACID	A,B	3E7J	0.77
GCU	D-GLUCURONIC ACID	A	1CB8	0.77
GCU	D-GLUCURONIC ACID	A	1HV6	0.77
GCU	D-GLUCURONIC ACID	A	1HMU	0.77
GCU	D-GLUCURONIC ACID	A,B,C	3E80	0.77
GCU	D-GLUCURONIC ACID	A,B	2VZR	0.77
GCU	D-GLUCURONIC ACID	A	2HYA	0.77
GCU	D-GLUCURONIC ACID	A	1OFL	0.77
GCU	D-GLUCURONIC ACID	A,B	2W87	0.77
GCU	D-GLUCURONIC ACID	A	1MQQ	0.77
GCU	D-GLUCURONIC ACID	A	1HM2	0.77
GCU	D-GLUCURONIC ACID	A	1HYA	0.77
GCU	D-GLUCURONIC ACID	A	2C4S	0.77
GCU	D-GLUCURONIC ACID	A	4HYA	0.77
GCU	D-GLUCURONIC ACID	A	1C4S	0.77
GCU	D-GLUCURONIC ACID	A	1HM3	0.77
GCU	D-GLUCURONIC ACID	A	1DBO	0.77
KDF	3-deoxy-alpha-D-erythro-hex-2-ulofuranosonic acid	A,B,C	2VAR	0.71
IDX	2-O-sulfo-alpha-L-gulopyranuronic acid	1	1QQP	0.72
GC4	4-DEOXY-D-GLUCURONIC ACID	A	1I8Q	0.74
GC4	4-DEOXY-D-GLUCURONIC ACID	A	1C4S	0.74
GC4	4-DEOXY-D-GLUCURONIC ACID	A	1DBO	0.74
GTR	GALACTURONIC ACID	A	1KCD	0.77
GTR	GALACTURONIC ACID	A	1KCC	0.77
GTR	GALACTURONIC ACID	A	1N7Q	0.77
IDR	L-IDURONIC ACID	A	2V38	0.77
IDR	L-IDURONIC ACID	A	1HM2	0.77
IDR	L-IDURONIC ACID	A	2ERM	0.77
GU1	2,3-DI-O-METHYL-BETA-D-GLUCOPYRANURONIC ACID	H,I	1TB6	0.81
GU1	2,3-DI-O-METHYL-BETA-D-GLUCOPYRANURONIC ACID	A,B,D,I	2B5T	0.81
IDU	2-O-sulfo-beta-L-altropyranuronic acid	A,B	2BRS	0.72
IDU	2-O-sulfo-beta-L-altropyranuronic acid	A,B	1FQ9	0.72
ADA	ALPHA-D-GALACTOPYRANURONIC ACID	C,D	2NST	0.77
ADA	ALPHA-D-GALACTOPYRANURONIC ACID	A	1GXO	0.77
ADA	ALPHA-D-GALACTOPYRANURONIC ACID	A	2EWE	0.77
ADA	ALPHA-D-GALACTOPYRANURONIC ACID	A	2UVH	0.77
ADA	ALPHA-D-GALACTOPYRANURONIC ACID	A	2O04	0.77
ADA	ALPHA-D-GALACTOPYRANURONIC ACID	C,D	2NTB	0.77
ADA	ALPHA-D-GALACTOPYRANURONIC ACID	C,D	2NT9	0.77
ADA	ALPHA-D-GALACTOPYRANURONIC ACID	A	2NZM	0.77
ADA	ALPHA-D-GALACTOPYRANURONIC ACID	A,B	2Z8S	0.77
ADA	ALPHA-D-GALACTOPYRANURONIC ACID	A	2UVJ	0.77
ADA	ALPHA-D-GALACTOPYRANURONIC ACID	A	2O0V	0.77
ADA	ALPHA-D-GALACTOPYRANURONIC ACID	C,D	2NSP	0.77
ADA	ALPHA-D-GALACTOPYRANURONIC ACID	A,B	3B8Y	0.77
ADA	ALPHA-D-GALACTOPYRANURONIC ACID	C,D	2NT6	0.77
ADA	ALPHA-D-GALACTOPYRANURONIC ACID	A	2O17	0.77
ADA	ALPHA-D-GALACTOPYRANURONIC ACID	C,D	2NTP	0.77
ADA	ALPHA-D-GALACTOPYRANURONIC ACID	A	2O1D	0.77
ADA	ALPHA-D-GALACTOPYRANURONIC ACID	C,D	2NTQ	0.77
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
GU2	2,3-DI-O-METHYL-ALPHA-L-IDOPYRANURONIC ACID	A,B,D,I	2B5T	0.81
GU2	2,3-DI-O-METHYL-ALPHA-L-IDOPYRANURONIC ACID	H,I	1TB6	0.81