MMsInc Molecule/ Ligand PDB

Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02214672

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
GU2	2,3-DI-O-METHYL-ALPHA-L-IDOPYRANURONIC ACID	A,B,D,I	2B5T	0.75
GU2	2,3-DI-O-METHYL-ALPHA-L-IDOPYRANURONIC ACID	H,I	1TB6	0.75
SHB	methyl beta-D-galactopyranuronate	C,D	2NTP	0.74
GCW	4-O-METHYL-BETA-D-GLUCURONIC ACID	A	1L8N	0.75
GCV	4-O-METHYL-ALPHA-D-GLUCURONIC ACID	A	1K9E	0.75
GCV	4-O-METHYL-ALPHA-D-GLUCURONIC ACID	A,B	1V6X	0.75
GCV	4-O-METHYL-ALPHA-D-GLUCURONIC ACID	A	1UQZ	0.75
GCV	4-O-METHYL-ALPHA-D-GLUCURONIC ACID	A,B	1H41	0.75
GCV	4-O-METHYL-ALPHA-D-GLUCURONIC ACID	A	1K9F	0.75
GCV	4-O-METHYL-ALPHA-D-GLUCURONIC ACID	A,B	1V6W	0.75
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
AD0	DIGALACTURONIC ACID	A,B	2UVF	0.71
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	0.73
GU1	2,3-DI-O-METHYL-BETA-D-GLUCOPYRANURONIC ACID	H,I	1TB6	0.75
GU1	2,3-DI-O-METHYL-BETA-D-GLUCOPYRANURONIC ACID	A,B,D,I	2B5T	0.75
TFB	TETRAHYDROFURAN-2-CARBOXYLIC ACID	A	1TIW	0.72
TFB	TETRAHYDROFURAN-2-CARBOXYLIC ACID	A	3E2R	0.72
TFB	TETRAHYDROFURAN-2-CARBOXYLIC ACID	A	1KB0	0.72
LGC	(3S,4R,5R,6S)-3,4,5-TRIHYDROXY- 6-(HYDROXYMETHYL)TETRAHYDRO-2H- PYRAN-2-ONE	M	1E6X	0.71
LGC	(3S,4R,5R,6S)-3,4,5-TRIHYDROXY- 6-(HYDROXYMETHYL)TETRAHYDRO-2H- PYRAN-2-ONE	A,B	2E40	0.71
LGC	(3S,4R,5R,6S)-3,4,5-TRIHYDROXY- 6-(HYDROXYMETHYL)TETRAHYDRO-2H- PYRAN-2-ONE	A	2VWG	0.71
LGC	(3S,4R,5R,6S)-3,4,5-TRIHYDROXY- 6-(HYDROXYMETHYL)TETRAHYDRO-2H- PYRAN-2-ONE	A,B	3EQO	0.71
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
149	D-GALCTOPYRANOSYL-1-ON	A,B,C,D	1JZ5	0.71
149	D-GALCTOPYRANOSYL-1-ON	A,B,C,D	3CZJ	0.71
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
GC1	2,6-ANHYDRO-L-GULONIC ACID	A	1HUA	0.72
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
KDF	3-deoxy-alpha-D-erythro-hex-2-ulofuranosonic acid	A,B,C	2VAR	0.78
3MF	3-O-METHYLFRUCTOSE IN LINEAR FORM	A,B	1XYC	0.71
M8C	METHYL ALPHA-D-GALACTOPYRANURONATE	C,D	2NST	0.74
M8C	METHYL ALPHA-D-GALACTOPYRANURONATE	C,D	2NSP	0.74
M8C	METHYL ALPHA-D-GALACTOPYRANURONATE	C,D	2NT9	0.74
M8C	METHYL ALPHA-D-GALACTOPYRANURONATE	C,D	2NTQ	0.74
M8C	METHYL ALPHA-D-GALACTOPYRANURONATE	C,D	2NTP	0.74
M8C	METHYL ALPHA-D-GALACTOPYRANURONATE	C,D	2NT6	0.74
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
AI2	3A-METHYL-5,6-DIHYDRO-FURO[2,3- D][1,3,2]DIOXABOROLE-2,2,6,6A-TETRAOL	A,B	2HJ9	0.71
AI2	3A-METHYL-5,6-DIHYDRO-FURO[2,3- D][1,3,2]DIOXABOROLE-2,2,6,6A-TETRAOL	A	1JX6	0.71
GTR	GALACTURONIC ACID	A	1KCD	0.73
GTR	GALACTURONIC ACID	A	1KCC	0.73
GTR	GALACTURONIC ACID	A	1N7Q	0.73
KO1	D-glycero-alpha-D-talo-oct-2-ulopyranosonic acid	A,B	2R23	0.71
DG0	4-O-alpha-D-galactopyranuronosyl- alpha-D-galactopyranuronic acid	A	3DYB	0.71