MMsInc Molecule/ Ligand PDB

Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03206978

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
RSH	3-DEOXY-D-LYXO-HEXONIC ACID	A,B,C,D	1W3T	0.78
GLR	2,3-DIHYDROXY-5-OXO-HEXANEDIOATE	A,B,C,D	1EC8	0.76
GLR	2,3-DIHYDROXY-5-OXO-HEXANEDIOATE	A,B,C,D	1JDF	0.76
DXG	4-DEOXYGLUCARATE	A,B,C,D	1ECQ	0.82
KDG	2-KETO-3-DEOXYGLUCONATE	A,B	1V1A	0.8
KDG	2-KETO-3-DEOXYGLUCONATE	A,B,C	2VAR	0.8
KDG	2-KETO-3-DEOXYGLUCONATE	A,B,C,D	2QJN	0.8
3MF	3-O-METHYLFRUCTOSE IN LINEAR FORM	A,B	1XYC	0.75
GKR	D-GLUCARATE	A	3CXT	0.84
GKR	D-GLUCARATE	A,B	1JCT	0.84
P6T	1,6-di-O-phosphono-D-tagatose	A,B	3GAY	0.73
XUL	D-XYLULOSE	A	3CWH	0.72
XUL	D-XYLULOSE	A	1XII	0.72
XUL	D-XYLULOSE	A,B	2ITM	0.72
3LR	3,6-dideoxy-L-arabino-hexonic acid	A,B	3CXO	0.77
IDS	O2-SULFO-GLUCURONIC ACID	1	1ZBA	0.77
IDS	O2-SULFO-GLUCURONIC ACID	A	2HYV	0.77
IDS	O2-SULFO-GLUCURONIC ACID	A	1BFC	0.77
IDS	O2-SULFO-GLUCURONIC ACID	A,B,C,D	2VRA	0.77
IDS	O2-SULFO-GLUCURONIC ACID	H,I	3B9F	0.77
IDS	O2-SULFO-GLUCURONIC ACID	B,C,D,E	1E0O	0.77
IDS	O2-SULFO-GLUCURONIC ACID	A	2HYU	0.77
IDS	O2-SULFO-GLUCURONIC ACID	A,B	3DY0	0.77
IDS	O2-SULFO-GLUCURONIC ACID	B	2AXM	0.77
IDS	O2-SULFO-GLUCURONIC ACID	A,B	1FQ9	0.77
IDS	O2-SULFO-GLUCURONIC ACID	A	1BFB	0.77
IDS	O2-SULFO-GLUCURONIC ACID	A,B	1T8U	0.77
IDS	O2-SULFO-GLUCURONIC ACID	A,B	1GMN	0.77
IDS	O2-SULFO-GLUCURONIC ACID	A	1XT3	0.77
IDS	O2-SULFO-GLUCURONIC ACID	A,B,C,D,E,F	1AXM	0.77
IDS	O2-SULFO-GLUCURONIC ACID	A,B,C,D,E,F, G,H	1GMO	0.77
IDS	O2-SULFO-GLUCURONIC ACID	A	2ERM	0.77
IDS	O2-SULFO-GLUCURONIC ACID	B,D,F,H	1XMN	0.77
IDS	O2-SULFO-GLUCURONIC ACID	A	1HPN	0.77
IDS	O2-SULFO-GLUCURONIC ACID	A	1G5N	0.77
IDS	O2-SULFO-GLUCURONIC ACID	1	1QQP	0.77
IDS	O2-SULFO-GLUCURONIC ACID	A,B	1RID	0.77
I1N	(2S,3R,4R,5S,6S)-2,3,4,5,6-PENTAHYDROXYCYCLOHEXANONE	A,B	2IBN	0.82
LGC	(3S,4R,5R,6S)-3,4,5-TRIHYDROXY- 6-(HYDROXYMETHYL)TETRAHYDRO-2H- PYRAN-2-ONE	M	1E6X	0.75
LGC	(3S,4R,5R,6S)-3,4,5-TRIHYDROXY- 6-(HYDROXYMETHYL)TETRAHYDRO-2H- PYRAN-2-ONE	A,B	2E40	0.75
LGC	(3S,4R,5R,6S)-3,4,5-TRIHYDROXY- 6-(HYDROXYMETHYL)TETRAHYDRO-2H- PYRAN-2-ONE	A	2VWG	0.75
LGC	(3S,4R,5R,6S)-3,4,5-TRIHYDROXY- 6-(HYDROXYMETHYL)TETRAHYDRO-2H- PYRAN-2-ONE	A,B	3EQO	0.75
AOS	D-ALLOSE	A,B,C,D	2I57	0.9
149	D-GALCTOPYRANOSYL-1-ON	A,B,C,D	1JZ5	0.75
149	D-GALCTOPYRANOSYL-1-ON	A,B,C,D	3CZJ	0.75
KDP	2-KETO-DEOXY-GALACTOSE	A	2V82	0.74
IDX	2-O-sulfo-alpha-L-gulopyranuronic acid	1	1QQP	0.77
2FP	1,6-FRUCTOSE DIPHOSPHATE (LINEAR FORM)	A,B,C,D	1FDJ	0.73
2FP	1,6-FRUCTOSE DIPHOSPHATE (LINEAR FORM)	A,B	6ALD	0.73
2FP	1,6-FRUCTOSE DIPHOSPHATE (LINEAR FORM)	A,B,C,D	1ZAI	0.73
2FP	1,6-FRUCTOSE DIPHOSPHATE (LINEAR FORM)	A,B,C,D	2QDG	0.73
2FP	1,6-FRUCTOSE DIPHOSPHATE (LINEAR FORM)	A	3ELF	0.73
2FP	1,6-FRUCTOSE DIPHOSPHATE (LINEAR FORM)	A	4ALD	0.73
2FP	1,6-FRUCTOSE DIPHOSPHATE (LINEAR FORM)	A	1UMG	0.73
DNO	D-mannose	A	3BDK	0.9
XLS	D-XYLOSE (LINEAR FORM)	A,B	2QW5	0.79
XLS	D-XYLOSE (LINEAR FORM)	A	2BRP	0.79
XLS	D-XYLOSE (LINEAR FORM)	A	3XIS	0.79
XLS	D-XYLOSE (LINEAR FORM)	A,B,C,D	8XIM	0.79
XLS	D-XYLOSE (LINEAR FORM)	A	4XIS	0.79
XLS	D-XYLOSE (LINEAR FORM)	A,B,C,D	9XIM	0.79
XLS	D-XYLOSE (LINEAR FORM)	A,B,C,D	5XIN	0.79
XLS	D-XYLOSE (LINEAR FORM)	A	8XIA	0.79
XLS	D-XYLOSE (LINEAR FORM)	A,B,C,D	6XIM	0.79
XLS	D-XYLOSE (LINEAR FORM)	A	1XIC	0.79
R52	5-O-phosphono-D-ribose	A,B,C,D,E	2VVP	0.72
LGT	L-GLUCARIC ACID	A,B,C,D	3CB3	0.84
LGT	L-GLUCARIC ACID	A,B,C	2PP3	0.84
GLO	D-GLUCOSE IN LINEAR FORM	A,B	1XYB	0.9
GLO	D-GLUCOSE IN LINEAR FORM	A	1FQD	0.9
GLO	D-GLUCOSE IN LINEAR FORM	A,B	1XYM	0.9
GLO	D-GLUCOSE IN LINEAR FORM	A,B	1EZ9	0.9
GLO	D-GLUCOSE IN LINEAR FORM	A	1FBO	0.9
GLO	D-GLUCOSE IN LINEAR FORM	A	1AC0	0.9
GLO	D-GLUCOSE IN LINEAR FORM	A	1FQC	0.9
P6F	1,6-di-O-phosphono-D-fructose	A,B	3GB6	0.73
6PG	6-PHOSPHOGLUCONIC ACID	A	1PGP	0.75
6PG	6-PHOSPHOGLUCONIC ACID	A,B	1J3R	0.75
6PG	6-PHOSPHOGLUCONIC ACID	A,B	1QY4	0.75
6PG	6-PHOSPHOGLUCONIC ACID	A,B	2W8Z	0.75
6PG	6-PHOSPHOGLUCONIC ACID	A,B	3E7F	0.75
6PG	6-PHOSPHOGLUCONIC ACID	A,B	2W90	0.75
6PG	6-PHOSPHOGLUCONIC ACID	A,B	1KO8	0.75
6PG	6-PHOSPHOGLUCONIC ACID	A,B	2CXR	0.75
6PG	6-PHOSPHOGLUCONIC ACID	A	2IYO	0.75
6PG	6-PHOSPHOGLUCONIC ACID	A,B	1DQR	0.75
RNS	L-RHAMNOSE	A,B,C,D	1X8D	0.83
RNS	L-RHAMNOSE	A,B,C,D	1DE6	0.83
RNS	L-RHAMNOSE	A,B,C,D	2I56	0.83
SSH	3-DEOXY-D-ARABINO-HEXONIC ACID	A,B,C,D	1W3N	0.78
CS2	D-MANNONIC ACID	A,B,C,D	2QJM	0.82
CS2	D-MANNONIC ACID	A,B	3DBN	0.82
GCT	4,5-DIHYDROXY-TETRAHYDRO-PYRAN- 2-CARBOXYLIC ACID	A	1RWG	0.7
GCT	4,5-DIHYDROXY-TETRAHYDRO-PYRAN- 2-CARBOXYLIC ACID	A	1RWF	0.7
GCT	4,5-DIHYDROXY-TETRAHYDRO-PYRAN- 2-CARBOXYLIC ACID	A	1RWH	0.7
I22	D-ALTRO-HEPT-2-ULOSE 7-PHOSPHATE	B	2I22	0.75
IDU	2-O-sulfo-beta-L-altropyranuronic acid	A,B	2BRS	0.77
IDU	2-O-sulfo-beta-L-altropyranuronic acid	A,B	1FQ9	0.77
LFC	6-DEOXY-L-GALACTONIC ACID	A	2HXU	0.8
GCO	GLUCONIC ACID	B,C,D	1BGG	0.82
GCO	GLUCONIC ACID	A,B	1XLF	0.82
G6Q	GLUCOSE-6-PHOSPHATE	A,B	3FF1	0.83
G6Q	GLUCOSE-6-PHOSPHATE	A,B,C	2O2C	0.83
G6Q	GLUCOSE-6-PHOSPHATE	A,B	2J6H	0.83
G6Q	GLUCOSE-6-PHOSPHATE	A,B	1JXA	0.83
G6Q	GLUCOSE-6-PHOSPHATE	A,B	1U0F	0.83
G6Q	GLUCOSE-6-PHOSPHATE	A,B	1X9I	0.83
F6R	FRUCTOSE -6-PHOSPHATE	A,B	1X9H	0.75
F6R	FRUCTOSE -6-PHOSPHATE	A,B,C,D	2PUT	0.75
F6R	FRUCTOSE -6-PHOSPHATE	A,B	2BKX	0.75
F6R	FRUCTOSE -6-PHOSPHATE	A,B,C	2BPL	0.75
F6R	FRUCTOSE -6-PHOSPHATE	A,B	1FQO	0.75
F6R	FRUCTOSE -6-PHOSPHATE	A,B,C,D	2V4M	0.75
TAG	D-tagatose	A,B,C,D	2QUM	0.81
FUD	D-fructose	A,B,C,D	2QUN	0.81
LG6	L-GULURONIC ACID 6-PHOSPHATE	A,B	1KW1	0.75
LG6	L-GULURONIC ACID 6-PHOSPHATE	A,B	1Q6O	0.75
GC1	2,6-ANHYDRO-L-GULONIC ACID	A	1HUA	0.74