MMsInc Molecule/ Ligand PDB

Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03355542

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
LFC	6-DEOXY-L-GALACTONIC ACID	A	2HXU	0.7
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
FKD	2,6-ANHYDRO-3-DEOXY-3-FLUORO-L- ARABINO-D-GALACTO-NONONIC ACID	A	2AGS	0.74
MGE	(1S)-2-(ALPHA-L-ALLOPYRANOSYLOXY)- 1-[(TRIDECANOYLOXY)METHYL]ETHYL PALMITATE	A,B,C,D,F,H, K,L,T,V,Z	3A0H	0.71
MGE	(1S)-2-(ALPHA-L-ALLOPYRANOSYLOXY)- 1-[(TRIDECANOYLOXY)METHYL]ETHYL PALMITATE	A,B,C,D,F,H, I,K,L,M,T,V,X	2AXT	0.71
MGE	(1S)-2-(ALPHA-L-ALLOPYRANOSYLOXY)- 1-[(TRIDECANOYLOXY)METHYL]ETHYL PALMITATE	A,B,C,D,E,H, J,K,L,T,V,Z	3A0B	0.71
CRB	[1R-(1ALPHA,3BETA,4ALPHA,5BETA)]- 5-(PHOSPHONOMETHYL)-1,3,4-TRIHYDROXYCYCLOHEXANE- 1-CARBOXYLIC ACID	A,B	1XAI	0.75
CRB	[1R-(1ALPHA,3BETA,4ALPHA,5BETA)]- 5-(PHOSPHONOMETHYL)-1,3,4-TRIHYDROXYCYCLOHEXANE- 1-CARBOXYLIC ACID	A,B	1NVD	0.75
CRB	[1R-(1ALPHA,3BETA,4ALPHA,5BETA)]- 5-(PHOSPHONOMETHYL)-1,3,4-TRIHYDROXYCYCLOHEXANE- 1-CARBOXYLIC ACID	A	1XAG	0.75
CRB	[1R-(1ALPHA,3BETA,4ALPHA,5BETA)]- 5-(PHOSPHONOMETHYL)-1,3,4-TRIHYDROXYCYCLOHEXANE- 1-CARBOXYLIC ACID	A,B	1NR5	0.75
CRB	[1R-(1ALPHA,3BETA,4ALPHA,5BETA)]- 5-(PHOSPHONOMETHYL)-1,3,4-TRIHYDROXYCYCLOHEXANE- 1-CARBOXYLIC ACID	A,B	1XAJ	0.75
CRB	[1R-(1ALPHA,3BETA,4ALPHA,5BETA)]- 5-(PHOSPHONOMETHYL)-1,3,4-TRIHYDROXYCYCLOHEXANE- 1-CARBOXYLIC ACID	A,B	1XAL	0.75
CRB	[1R-(1ALPHA,3BETA,4ALPHA,5BETA)]- 5-(PHOSPHONOMETHYL)-1,3,4-TRIHYDROXYCYCLOHEXANE- 1-CARBOXYLIC ACID	A,B	1DQS	0.75
CRB	[1R-(1ALPHA,3BETA,4ALPHA,5BETA)]- 5-(PHOSPHONOMETHYL)-1,3,4-TRIHYDROXYCYCLOHEXANE- 1-CARBOXYLIC ACID	A,B	1NVB	0.75
CRB	[1R-(1ALPHA,3BETA,4ALPHA,5BETA)]- 5-(PHOSPHONOMETHYL)-1,3,4-TRIHYDROXYCYCLOHEXANE- 1-CARBOXYLIC ACID	A,B,C	1NVF	0.75
GU2	2,3-DI-O-METHYL-ALPHA-L-IDOPYRANURONIC ACID	A,B,D,I	2B5T	0.73
GU2	2,3-DI-O-METHYL-ALPHA-L-IDOPYRANURONIC ACID	H,I	1TB6	0.73
GKR	D-GLUCARATE	A	3CXT	0.7
GKR	D-GLUCARATE	A,B	1JCT	0.7
PII	2-[(HYDROXY{[(2R,3R,5S,6R)-2,3,4,5,6- PENTAHYDROXYCYCLOHEXYL]OXY}PHOSPHORYL)OXY]- 1-[(PALMITOYLOXY)METHYL]ETHYL HEPTADECANOATE	A	1GZQ	0.71
DEB	6-DEOXYERYTHRONOLIDE B	A	1Z8P	0.8
DEB	6-DEOXYERYTHRONOLIDE B	A	1JIO	0.8
DEB	6-DEOXYERYTHRONOLIDE B	A	1Z8Q	0.8
DEB	6-DEOXYERYTHRONOLIDE B	A	1OXA	0.8
DEB	6-DEOXYERYTHRONOLIDE B	A	1Z8O	0.8
149	D-GALCTOPYRANOSYL-1-ON	A,B,C,D	1JZ5	0.74
149	D-GALCTOPYRANOSYL-1-ON	A,B,C,D	3CZJ	0.74
DQA	1,3,4-TRIHYDROXY-5-OXO-CYCLOHEXANECARBOXYLIC ACID	A	1J2Y	0.8
DR4	METHYL 9-(BETA-D-TALOPYRANOSYLOXY)NONANOATE	A	1ZJO	0.73
DR4	METHYL 9-(BETA-D-TALOPYRANOSYLOXY)NONANOATE	A	1ZJP	0.73
LGC	(3S,4R,5R,6S)-3,4,5-TRIHYDROXY- 6-(HYDROXYMETHYL)TETRAHYDRO-2H- PYRAN-2-ONE	M	1E6X	0.74
LGC	(3S,4R,5R,6S)-3,4,5-TRIHYDROXY- 6-(HYDROXYMETHYL)TETRAHYDRO-2H- PYRAN-2-ONE	A,B	2E40	0.74
LGC	(3S,4R,5R,6S)-3,4,5-TRIHYDROXY- 6-(HYDROXYMETHYL)TETRAHYDRO-2H- PYRAN-2-ONE	A	2VWG	0.74
LGC	(3S,4R,5R,6S)-3,4,5-TRIHYDROXY- 6-(HYDROXYMETHYL)TETRAHYDRO-2H- PYRAN-2-ONE	A,B	3EQO	0.74
LMG	1,2-DISTEAROYL-MONOGALACTOSYL-DIGLYCERIDE	A,B,C,F,I,J, K,L,M,X	1JB0	0.71
LMG	1,2-DISTEAROYL-MONOGALACTOSYL-DIGLYCERIDE	A,B,C,D,E,F, H,I,J,K,M,O, T,V,Z	3BZ1	0.71
LMG	1,2-DISTEAROYL-MONOGALACTOSYL-DIGLYCERIDE	A,B,C,D,L,R	1Q90	0.71
LMG	1,2-DISTEAROYL-MONOGALACTOSYL-DIGLYCERIDE	A,B,C,D,E,F, H,I,J,K,L,M, O,T,V,X,Z	3BZ2	0.71
AD0	DIGALACTURONIC ACID	A,B	2UVF	0.71
B3H	(2S)-2-(BUTYRYLOXY)-3-HYDROXYPROPYL NONANOATE	C,D	2HFE	0.7
B3H	(2S)-2-(BUTYRYLOXY)-3-HYDROXYPROPYL NONANOATE	C,D	2H8P	0.7
B3H	(2S)-2-(BUTYRYLOXY)-3-HYDROXYPROPYL NONANOATE	C,D	2HG5	0.7
GU1	2,3-DI-O-METHYL-BETA-D-GLUCOPYRANURONIC ACID	H,I	1TB6	0.73
GU1	2,3-DI-O-METHYL-BETA-D-GLUCOPYRANURONIC ACID	A,B,D,I	2B5T	0.73
KDO	3-DEOXY-D-MANNO-OCT-2-ULOSONIC ACID	A,B,C	1Q9W	0.74
KDO	3-DEOXY-D-MANNO-OCT-2-ULOSONIC ACID	A,B	3DUV	0.74
KDO	3-DEOXY-D-MANNO-OCT-2-ULOSONIC ACID	A,B,C,D	3DUS	0.74
KDO	3-DEOXY-D-MANNO-OCT-2-ULOSONIC ACID	A	1QJQ	0.74
KDO	3-DEOXY-D-MANNO-OCT-2-ULOSONIC ACID	A,B	1Q9R	0.74
KDO	3-DEOXY-D-MANNO-OCT-2-ULOSONIC ACID	A	1QFF	0.74
KDO	3-DEOXY-D-MANNO-OCT-2-ULOSONIC ACID	A	2FCP	0.74
KDO	3-DEOXY-D-MANNO-OCT-2-ULOSONIC ACID	A,B	1Q9Q	0.74
KDO	3-DEOXY-D-MANNO-OCT-2-ULOSONIC ACID	A,B	3DV4	0.74
KDO	3-DEOXY-D-MANNO-OCT-2-ULOSONIC ACID	A,B,C,D	3FXI	0.74
KDO	3-DEOXY-D-MANNO-OCT-2-ULOSONIC ACID	A,B	2R2B	0.74
KDO	3-DEOXY-D-MANNO-OCT-2-ULOSONIC ACID	A	1FCP	0.74
KDO	3-DEOXY-D-MANNO-OCT-2-ULOSONIC ACID	A	1FI1	0.74
KDO	3-DEOXY-D-MANNO-OCT-2-ULOSONIC ACID	A,B,C,D	3DUU	0.74
KDO	3-DEOXY-D-MANNO-OCT-2-ULOSONIC ACID	A,B	1Q9V	0.74
KDO	3-DEOXY-D-MANNO-OCT-2-ULOSONIC ACID	A	1QFG	0.74
KDO	3-DEOXY-D-MANNO-OCT-2-ULOSONIC ACID	A	1QKC	0.74
KDO	3-DEOXY-D-MANNO-OCT-2-ULOSONIC ACID	A,B,C,D	3DUR	0.74
KDO	3-DEOXY-D-MANNO-OCT-2-ULOSONIC ACID	A,B	2R1Y	0.74
KDO	3-DEOXY-D-MANNO-OCT-2-ULOSONIC ACID	A,B	1Q9T	0.74
KDO	3-DEOXY-D-MANNO-OCT-2-ULOSONIC ACID	A,B	3DV6	0.74
KDO	3-DEOXY-D-MANNO-OCT-2-ULOSONIC ACID	A,B	2GRX	0.74
GC1	2,6-ANHYDRO-L-GULONIC ACID	A	1HUA	0.72
F24	(3R,5S,7R,12S,13R)-13-FORMYL-12,14- DIHYDROXY-3,5,7-TRIMETHYLTETRADECANOIC ACID	A	2F9A	0.7
SHB	methyl beta-D-galactopyranuronate	C,D	2NTP	0.71
LGT	L-GLUCARIC ACID	A,B,C,D	3CB3	0.7
LGT	L-GLUCARIC ACID	A,B,C	2PP3	0.7
KO1	D-glycero-alpha-D-talo-oct-2-ulopyranosonic acid	A,B	2R23	0.76
DG0	4-O-alpha-D-galactopyranuronosyl- alpha-D-galactopyranuronic acid	A	3DYB	0.71