MMsInc Molecule/ Ligand PDB

Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03206682

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
GCU	D-GLUCURONIC ACID	A	1HMW	0.73
GCU	D-GLUCURONIC ACID	A	2JCQ	0.73
GCU	D-GLUCURONIC ACID	A	3HYA	0.73
GCU	D-GLUCURONIC ACID	A,B	2FUQ	0.73
GCU	D-GLUCURONIC ACID	A	1DBG	0.73
GCU	D-GLUCURONIC ACID	A	1FCV	0.73
GCU	D-GLUCURONIC ACID	A	1OFM	0.73
GCU	D-GLUCURONIC ACID	A,B	3E7J	0.73
GCU	D-GLUCURONIC ACID	A	1CB8	0.73
GCU	D-GLUCURONIC ACID	A	1HV6	0.73
GCU	D-GLUCURONIC ACID	A	1HMU	0.73
GCU	D-GLUCURONIC ACID	A,B,C	3E80	0.73
GCU	D-GLUCURONIC ACID	A,B	2VZR	0.73
GCU	D-GLUCURONIC ACID	A	2HYA	0.73
GCU	D-GLUCURONIC ACID	A	1OFL	0.73
GCU	D-GLUCURONIC ACID	A,B	2W87	0.73
GCU	D-GLUCURONIC ACID	A	1MQQ	0.73
GCU	D-GLUCURONIC ACID	A	1HM2	0.73
GCU	D-GLUCURONIC ACID	A	1HYA	0.73
GCU	D-GLUCURONIC ACID	A	2C4S	0.73
GCU	D-GLUCURONIC ACID	A	4HYA	0.73
GCU	D-GLUCURONIC ACID	A	1C4S	0.73
GCU	D-GLUCURONIC ACID	A	1HM3	0.73
GCU	D-GLUCURONIC ACID	A	1DBO	0.73
BDP	BETA-D-GALACTOPYRANURONIC ACID	A	1N7R	0.73
BDP	BETA-D-GALACTOPYRANURONIC ACID	A	3C9E	0.73
BDP	BETA-D-GALACTOPYRANURONIC ACID	A	1LOH	0.73
BDP	BETA-D-GALACTOPYRANURONIC ACID	A	1CAP	0.73
BDP	BETA-D-GALACTOPYRANURONIC ACID	A	1HM3	0.73
BDP	BETA-D-GALACTOPYRANURONIC ACID	A	1HUA	0.73
BDP	BETA-D-GALACTOPYRANURONIC ACID	A	1LXK	0.73
BDP	BETA-D-GALACTOPYRANURONIC ACID	A,B	1GQK	0.73
BDP	BETA-D-GALACTOPYRANURONIC ACID	A,B	1ON8	0.73
BDP	BETA-D-GALACTOPYRANURONIC ACID	P	2BVK	0.73
BDP	BETA-D-GALACTOPYRANURONIC ACID	A	2JCR	0.73
BDP	BETA-D-GALACTOPYRANURONIC ACID	A	1LXM	0.73
BDP	BETA-D-GALACTOPYRANURONIC ACID	A	1HMW	0.73
BDP	BETA-D-GALACTOPYRANURONIC ACID	A	3HYA	0.73
BDP	BETA-D-GALACTOPYRANURONIC ACID	A,B	1GQL	0.73
BDP	BETA-D-GALACTOPYRANURONIC ACID	A	1OFM	0.73
BDP	BETA-D-GALACTOPYRANURONIC ACID	A	1N7Q	0.73
LFC	6-DEOXY-L-GALACTONIC ACID	A	2HXU	0.86
GLR	2,3-DIHYDROXY-5-OXO-HEXANEDIOATE	A,B,C,D	1EC8	0.81
GLR	2,3-DIHYDROXY-5-OXO-HEXANEDIOATE	A,B,C,D	1JDF	0.81
M8C	METHYL ALPHA-D-GALACTOPYRANURONATE	C,D	2NST	0.71
M8C	METHYL ALPHA-D-GALACTOPYRANURONATE	C,D	2NSP	0.71
M8C	METHYL ALPHA-D-GALACTOPYRANURONATE	C,D	2NT9	0.71
M8C	METHYL ALPHA-D-GALACTOPYRANURONATE	C,D	2NTQ	0.71
M8C	METHYL ALPHA-D-GALACTOPYRANURONATE	C,D	2NTP	0.71
M8C	METHYL ALPHA-D-GALACTOPYRANURONATE	C,D	2NT6	0.71
GC1	2,6-ANHYDRO-L-GULONIC ACID	A	1HUA	0.79
I1N	(2S,3R,4R,5S,6S)-2,3,4,5,6-PENTAHYDROXYCYCLOHEXANONE	A,B	2IBN	0.88
F6R	FRUCTOSE -6-PHOSPHATE	A,B	1X9H	0.76
F6R	FRUCTOSE -6-PHOSPHATE	A,B,C,D	2PUT	0.76
F6R	FRUCTOSE -6-PHOSPHATE	A,B	2BKX	0.76
F6R	FRUCTOSE -6-PHOSPHATE	A,B,C	2BPL	0.76
F6R	FRUCTOSE -6-PHOSPHATE	A,B	1FQO	0.76
F6R	FRUCTOSE -6-PHOSPHATE	A,B,C,D	2V4M	0.76
GKR	D-GLUCARATE	A	3CXT	0.86
GKR	D-GLUCARATE	A,B	1JCT	0.86
GCW	4-O-METHYL-BETA-D-GLUCURONIC ACID	A	1L8N	0.72
GCV	4-O-METHYL-ALPHA-D-GLUCURONIC ACID	A	1K9E	0.72
GCV	4-O-METHYL-ALPHA-D-GLUCURONIC ACID	A,B	1V6X	0.72
GCV	4-O-METHYL-ALPHA-D-GLUCURONIC ACID	A	1UQZ	0.72
GCV	4-O-METHYL-ALPHA-D-GLUCURONIC ACID	A,B	1H41	0.72
GCV	4-O-METHYL-ALPHA-D-GLUCURONIC ACID	A	1K9F	0.72
GCV	4-O-METHYL-ALPHA-D-GLUCURONIC ACID	A,B	1V6W	0.72
XUL	D-XYLULOSE	A	3CWH	0.77
XUL	D-XYLULOSE	A	1XII	0.77
XUL	D-XYLULOSE	A,B	2ITM	0.77
DXG	4-DEOXYGLUCARATE	A,B,C,D	1ECQ	0.88
P6T	1,6-di-O-phosphono-D-tagatose	A,B	3GAY	0.75
2FP	1,6-FRUCTOSE DIPHOSPHATE (LINEAR FORM)	A,B,C,D	1FDJ	0.75
2FP	1,6-FRUCTOSE DIPHOSPHATE (LINEAR FORM)	A,B	6ALD	0.75
2FP	1,6-FRUCTOSE DIPHOSPHATE (LINEAR FORM)	A,B,C,D	1ZAI	0.75
2FP	1,6-FRUCTOSE DIPHOSPHATE (LINEAR FORM)	A,B,C,D	2QDG	0.75
2FP	1,6-FRUCTOSE DIPHOSPHATE (LINEAR FORM)	A	3ELF	0.75
2FP	1,6-FRUCTOSE DIPHOSPHATE (LINEAR FORM)	A	4ALD	0.75
2FP	1,6-FRUCTOSE DIPHOSPHATE (LINEAR FORM)	A	1UMG	0.75
G6Q	GLUCOSE-6-PHOSPHATE	A,B	3FF1	0.85
G6Q	GLUCOSE-6-PHOSPHATE	A,B,C	2O2C	0.85
G6Q	GLUCOSE-6-PHOSPHATE	A,B	2J6H	0.85
G6Q	GLUCOSE-6-PHOSPHATE	A,B	1JXA	0.85
G6Q	GLUCOSE-6-PHOSPHATE	A,B	1U0F	0.85
G6Q	GLUCOSE-6-PHOSPHATE	A,B	1X9I	0.85
BEM	beta-D-mannuronic acid	A	2ZAA	0.73
BEM	beta-D-mannuronic acid	A	2ZAC	0.73
BEM	beta-D-mannuronic acid	A	2ZAB	0.73
BEM	beta-D-mannuronic acid	A	1Y3N	0.73
BEM	beta-D-mannuronic acid	A	1Y3P	0.73
BEM	beta-D-mannuronic acid	A,B	1J1N	0.73
GLO	D-GLUCOSE IN LINEAR FORM	A,B	1XYB	0.98
GLO	D-GLUCOSE IN LINEAR FORM	A	1FQD	0.98
GLO	D-GLUCOSE IN LINEAR FORM	A,B	1XYM	0.98
GLO	D-GLUCOSE IN LINEAR FORM	A,B	1EZ9	0.98
GLO	D-GLUCOSE IN LINEAR FORM	A	1FBO	0.98
GLO	D-GLUCOSE IN LINEAR FORM	A	1AC0	0.98
GLO	D-GLUCOSE IN LINEAR FORM	A	1FQC	0.98
RSH	3-DEOXY-D-LYXO-HEXONIC ACID	A,B,C,D	1W3T	0.84
XLS	D-XYLOSE (LINEAR FORM)	A,B	2QW5	0.85
XLS	D-XYLOSE (LINEAR FORM)	A	2BRP	0.85
XLS	D-XYLOSE (LINEAR FORM)	A	3XIS	0.85
XLS	D-XYLOSE (LINEAR FORM)	A,B,C,D	8XIM	0.85
XLS	D-XYLOSE (LINEAR FORM)	A	4XIS	0.85
XLS	D-XYLOSE (LINEAR FORM)	A,B,C,D	9XIM	0.85
XLS	D-XYLOSE (LINEAR FORM)	A,B,C,D	5XIN	0.85
XLS	D-XYLOSE (LINEAR FORM)	A	8XIA	0.85
XLS	D-XYLOSE (LINEAR FORM)	A,B,C,D	6XIM	0.85
XLS	D-XYLOSE (LINEAR FORM)	A	1XIC	0.85
LG6	L-GULURONIC ACID 6-PHOSPHATE	A,B	1KW1	0.77
LG6	L-GULURONIC ACID 6-PHOSPHATE	A,B	1Q6O	0.77
3LR	3,6-dideoxy-L-arabino-hexonic acid	A,B	3CXO	0.82
KDP	2-KETO-DEOXY-GALACTOSE	A	2V82	0.76
AOS	D-ALLOSE	A,B,C,D	2I57	0.98
RNS	L-RHAMNOSE	A,B,C,D	1X8D	0.9
RNS	L-RHAMNOSE	A,B,C,D	1DE6	0.9
RNS	L-RHAMNOSE	A,B,C,D	2I56	0.9
LGU	ALPHA-L-GULURONATE	A	2ZAC	0.73
LGU	ALPHA-L-GULURONATE	A	2ZAA	0.73
LGU	ALPHA-L-GULURONATE	A,B	2QJR	0.73
LGU	ALPHA-L-GULURONATE	A	2ZAB	0.73
LGU	ALPHA-L-GULURONATE	A,B	1J1N	0.73
LGU	ALPHA-L-GULURONATE	A	1Y3P	0.73
ADA	ALPHA-D-GALACTOPYRANURONIC ACID	C,D	2NST	0.73
ADA	ALPHA-D-GALACTOPYRANURONIC ACID	A	1GXO	0.73
ADA	ALPHA-D-GALACTOPYRANURONIC ACID	A	2EWE	0.73
ADA	ALPHA-D-GALACTOPYRANURONIC ACID	A	2UVH	0.73
ADA	ALPHA-D-GALACTOPYRANURONIC ACID	A	2O04	0.73
ADA	ALPHA-D-GALACTOPYRANURONIC ACID	C,D	2NTB	0.73
ADA	ALPHA-D-GALACTOPYRANURONIC ACID	C,D	2NT9	0.73
ADA	ALPHA-D-GALACTOPYRANURONIC ACID	A	2NZM	0.73
ADA	ALPHA-D-GALACTOPYRANURONIC ACID	A,B	2Z8S	0.73
ADA	ALPHA-D-GALACTOPYRANURONIC ACID	A	2UVJ	0.73
ADA	ALPHA-D-GALACTOPYRANURONIC ACID	A	2O0V	0.73
ADA	ALPHA-D-GALACTOPYRANURONIC ACID	C,D	2NSP	0.73
ADA	ALPHA-D-GALACTOPYRANURONIC ACID	A,B	3B8Y	0.73
ADA	ALPHA-D-GALACTOPYRANURONIC ACID	C,D	2NT6	0.73
ADA	ALPHA-D-GALACTOPYRANURONIC ACID	A	2O17	0.73
ADA	ALPHA-D-GALACTOPYRANURONIC ACID	C,D	2NTP	0.73
ADA	ALPHA-D-GALACTOPYRANURONIC ACID	A	2O1D	0.73
ADA	ALPHA-D-GALACTOPYRANURONIC ACID	C,D	2NTQ	0.73
KBG	2-KETO-BETA-D-GLUCOSE	A	2F5V	0.71
KBG	2-KETO-BETA-D-GLUCOSE	A	1FQ7	0.71
GCO	GLUCONIC ACID	B,C,D	1BGG	0.88
GCO	GLUCONIC ACID	A,B	1XLF	0.88
DNO	D-mannose	A	3BDK	0.98
P6F	1,6-di-O-phosphono-D-fructose	A,B	3GB6	0.75
I22	D-ALTRO-HEPT-2-ULOSE 7-PHOSPHATE	B	2I22	0.77
MAV	D-MANNURONIC ACID	A,B	1J1N	0.73
MAV	D-MANNURONIC ACID	A	1Y3P	0.73
MAV	D-MANNURONIC ACID	A,B,D	2PYH	0.73
MAV	D-MANNURONIC ACID	A	1Y3N	0.73
MAV	D-MANNURONIC ACID	A	1HV6	0.73
IDR	L-IDURONIC ACID	A	2V38	0.73
IDR	L-IDURONIC ACID	A	1HM2	0.73
IDR	L-IDURONIC ACID	A	2ERM	0.73
LGC	(3S,4R,5R,6S)-3,4,5-TRIHYDROXY- 6-(HYDROXYMETHYL)TETRAHYDRO-2H- PYRAN-2-ONE	M	1E6X	0.8
LGC	(3S,4R,5R,6S)-3,4,5-TRIHYDROXY- 6-(HYDROXYMETHYL)TETRAHYDRO-2H- PYRAN-2-ONE	A,B	2E40	0.8
LGC	(3S,4R,5R,6S)-3,4,5-TRIHYDROXY- 6-(HYDROXYMETHYL)TETRAHYDRO-2H- PYRAN-2-ONE	A	2VWG	0.8
LGC	(3S,4R,5R,6S)-3,4,5-TRIHYDROXY- 6-(HYDROXYMETHYL)TETRAHYDRO-2H- PYRAN-2-ONE	A,B	3EQO	0.8
R52	5-O-phosphono-D-ribose	A,B,C,D,E	2VVP	0.74
SSH	3-DEOXY-D-ARABINO-HEXONIC ACID	A,B,C,D	1W3N	0.84
KDF	3-deoxy-alpha-D-erythro-hex-2-ulofuranosonic acid	A,B,C	2VAR	0.72
CS2	D-MANNONIC ACID	A,B,C,D	2QJM	0.88
CS2	D-MANNONIC ACID	A,B	3DBN	0.88
SHB	methyl beta-D-galactopyranuronate	C,D	2NTP	0.71
6PG	6-PHOSPHOGLUCONIC ACID	A	1PGP	0.77
6PG	6-PHOSPHOGLUCONIC ACID	A,B	1J3R	0.77
6PG	6-PHOSPHOGLUCONIC ACID	A,B	1QY4	0.77
6PG	6-PHOSPHOGLUCONIC ACID	A,B	2W8Z	0.77
6PG	6-PHOSPHOGLUCONIC ACID	A,B	3E7F	0.77
6PG	6-PHOSPHOGLUCONIC ACID	A,B	2W90	0.77
6PG	6-PHOSPHOGLUCONIC ACID	A,B	1KO8	0.77
6PG	6-PHOSPHOGLUCONIC ACID	A,B	2CXR	0.77
6PG	6-PHOSPHOGLUCONIC ACID	A	2IYO	0.77
6PG	6-PHOSPHOGLUCONIC ACID	A,B	1DQR	0.77
TAG	D-tagatose	A,B,C,D	2QUM	0.88
LGT	L-GLUCARIC ACID	A,B,C,D	3CB3	0.86
LGT	L-GLUCARIC ACID	A,B,C	2PP3	0.86
KDG	2-KETO-3-DEOXYGLUCONATE	A,B	1V1A	0.86
KDG	2-KETO-3-DEOXYGLUCONATE	A,B,C	2VAR	0.86
KDG	2-KETO-3-DEOXYGLUCONATE	A,B,C,D	2QJN	0.86
3MF	3-O-METHYLFRUCTOSE IN LINEAR FORM	A,B	1XYC	0.81
GCT	4,5-DIHYDROXY-TETRAHYDRO-PYRAN- 2-CARBOXYLIC ACID	A	1RWG	0.75
GCT	4,5-DIHYDROXY-TETRAHYDRO-PYRAN- 2-CARBOXYLIC ACID	A	1RWF	0.75
GCT	4,5-DIHYDROXY-TETRAHYDRO-PYRAN- 2-CARBOXYLIC ACID	A	1RWH	0.75
FUD	D-fructose	A,B,C,D	2QUN	0.88
1N5	(2R,4S)-2,4,7-trihydroxyheptanoic acid	A,B	3CXO	0.72
GC4	4-DEOXY-D-GLUCURONIC ACID	A	1I8Q	0.7
GC4	4-DEOXY-D-GLUCURONIC ACID	A	1C4S	0.7
GC4	4-DEOXY-D-GLUCURONIC ACID	A	1DBO	0.7
149	D-GALCTOPYRANOSYL-1-ON	A,B,C,D	1JZ5	0.8
149	D-GALCTOPYRANOSYL-1-ON	A,B,C,D	3CZJ	0.8
GTR	GALACTURONIC ACID	A	1KCD	0.73
GTR	GALACTURONIC ACID	A	1KCC	0.73
GTR	GALACTURONIC ACID	A	1N7Q	0.73