MMsInc Molecule/ Ligand PDB

Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03034154

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
IFL	(3S,4R,5R)-3,4-DIHYDROXY-5-(HYDROXYMETHYL)PIPERIDIN- 2-ONE	A,B	1UZ1	0.72
IFL	(3S,4R,5R)-3,4-DIHYDROXY-5-(HYDROXYMETHYL)PIPERIDIN- 2-ONE	A	2V38	0.72
IFL	(3S,4R,5R)-3,4-DIHYDROXY-5-(HYDROXYMETHYL)PIPERIDIN- 2-ONE	A,B	2VJX	0.72
IFL	(3S,4R,5R)-3,4-DIHYDROXY-5-(HYDROXYMETHYL)PIPERIDIN- 2-ONE	A	1UZ4	0.72
MNA	2-O-METHYL-5-N-ACETYL-ALPHA-D- NEURAMINIC ACID	A	2P3I	0.74
MNA	2-O-METHYL-5-N-ACETYL-ALPHA-D- NEURAMINIC ACID	A	1KQR	0.74
MNA	2-O-METHYL-5-N-ACETYL-ALPHA-D- NEURAMINIC ACID	A,B,C,D,E,F	1HGH	0.74
MNA	2-O-METHYL-5-N-ACETYL-ALPHA-D- NEURAMINIC ACID	A,B	2I2S	0.74
MNA	2-O-METHYL-5-N-ACETYL-ALPHA-D- NEURAMINIC ACID	A	2P3J	0.74
MNA	2-O-METHYL-5-N-ACETYL-ALPHA-D- NEURAMINIC ACID	A,B,C,D,E,F	1HGE	0.74
MNA	2-O-METHYL-5-N-ACETYL-ALPHA-D- NEURAMINIC ACID	A	2P3K	0.74
H5M	TRANS-3-HYDROXY-5-METHYLPROLINE	A,B	1A7Z	0.76
ABW	5-[1-(ACETYLAMINO)-3-METHYLBUTYL]- 2,5-ANHYDRO-3,4-DIDEOXY-4-(METHOXYCARBONYL)PENTONIC ACID	A	1XOG	0.71
NAV	6,7,8,9-TETRAHYDROXY-5-METHYLCARBOXAMIDO- 4-OXONONANOIC ACID	A,C	1F7B	0.87
FSI	5-(ACETYLAMINO)-2,6-ANHYDRO-3,5- DIDEOXY-3-FLUORONONONIC ACID	A	2AH2	0.75
FSI	5-(ACETYLAMINO)-2,6-ANHYDRO-3,5- DIDEOXY-3-FLUORONONONIC ACID	A	2FHR	0.75
FSI	5-(ACETYLAMINO)-2,6-ANHYDRO-3,5- DIDEOXY-3-FLUORONONONIC ACID	A	2A75	0.75
FSI	5-(ACETYLAMINO)-2,6-ANHYDRO-3,5- DIDEOXY-3-FLUORONONONIC ACID	A,B	2VK7	0.75
AMU	BETA-N-ACETYLMURAMIC ACID	A,B,C,D	2APH	0.7
AMU	BETA-N-ACETYLMURAMIC ACID	A,P	1TWQ	0.7
AMU	BETA-N-ACETYLMURAMIC ACID	A	1D0K	0.7
AMU	BETA-N-ACETYLMURAMIC ACID	S	9LYZ	0.7
AMU	BETA-N-ACETYLMURAMIC ACID	E,S	148L	0.7
AMU	BETA-N-ACETYLMURAMIC ACID	D,K	3CYQ	0.7
AMU	BETA-N-ACETYLMURAMIC ACID	U	2AIZ	0.7
MU2	N-ACETYLMURAMYL-L-ALANYL-D-ISOGLUTAMINE	A	2IXV	0.71
MU2	N-ACETYLMURAMYL-L-ALANYL-D-ISOGLUTAMINE	A	2IXU	0.71
AMN	9-DEOXY-9-AMINO-2-O-METHYL-5-N- ACETYL-ALPHA-D-NEURAMINIC ACID	A,B,C,D,E,F	1HGJ	0.73
6GP	METHYL-N-(BETA-D-GLUCOPYRANOSYL)OXAMATE	A	2F3Q	0.71
MUB	N-ACETYLMURAMIC ACID	L,N	1WCO	0.7
HMN	2,4,6,7,8,9-HEXAHYDROXY-5-METHYLCARBOXAMIDO NONANOIC ACID	A,B,C,D	1F73	0.82
E6C	N-[1-HYDROXYCARBOXYETHYL-CARBONYL]LEUCYLAMINO- 2-METHYL-BUTANE	A	1PPP	0.71
E6C	N-[1-HYDROXYCARBOXYETHYL-CARBONYL]LEUCYLAMINO- 2-METHYL-BUTANE	A	1PE6	0.71
E6C	N-[1-HYDROXYCARBOXYETHYL-CARBONYL]LEUCYLAMINO- 2-METHYL-BUTANE	A	1ITO	0.71
5AX	2-(ACETYLAMINO)-1,5-ANHYDRO-2-DEOXY- D-GLUCITOL	A	2JCQ	0.71
5AX	2-(ACETYLAMINO)-1,5-ANHYDRO-2-DEOXY- D-GLUCITOL	A,B	2IH9	0.71
5AX	2-(ACETYLAMINO)-1,5-ANHYDRO-2-DEOXY- D-GLUCITOL	A,B,C,D,E,F	2J2P	0.71
5AX	2-(ACETYLAMINO)-1,5-ANHYDRO-2-DEOXY- D-GLUCITOL	A	3DIV	0.71
GDL	2-ACETAMIDO-2-DEOXY-D-GLUCONO-1,5- LACTONE	A,B	1UR9	0.87
GDL	2-ACETAMIDO-2-DEOXY-D-GLUCONO-1,5- LACTONE	A,B,C,D,E,F	1O7A	0.87
GDL	2-ACETAMIDO-2-DEOXY-D-GLUCONO-1,5- LACTONE	A,B	1UR8	0.87
NAU	4,4,6,7,8,9-HEXAHYDROXY-5-METHYLCARBOXAMIDONONANOIC ACID	A,C	1F7B	0.8
4GP	N-(BETA-D-GLUCOPYRANOSYL)OXAMIC ACID	A	2F3P	0.71
G28	5-N-ACETYL-4-AMINO-6-DIETHYLCARBOXAMIDE- 4,5-DIHYDRO-2H-PYRAN-2-CARBOXYLIC ACID	A	2QWJ	0.7
G28	5-N-ACETYL-4-AMINO-6-DIETHYLCARBOXAMIDE- 4,5-DIHYDRO-2H-PYRAN-2-CARBOXYLIC ACID	A	2QWG	0.7
ANA	4-O-ACETYL-ALPHA-2-OMETHYL-5-N- ACETYL-ALPHA-D-NEURAMINIC ACID	A,B,C,D,E,F	1HGI	0.74
C6L	N-hexanoyl-L-homoserine	A	3DHA	0.74
C6L	N-hexanoyl-L-homoserine	A	3DHB	0.74