MMsInc Molecule/ Ligand PDB

Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02391225

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
9MR	(3R,4R,5R)-3-HYDROXY-5-(HYDROXYMETHYL)PIPERIDIN- 4-YL BETA-D-GLUCOPYRANOSIDE	A	3CUF	0.73
9MR	(3R,4R,5R)-3-HYDROXY-5-(HYDROXYMETHYL)PIPERIDIN- 4-YL BETA-D-GLUCOPYRANOSIDE	A,B	2OYK	0.73
AS5	2-(acetylamino)-4-O-[2-(acetylamino)- 2-deoxy-alpha-L-gulopyranosyl]- 1,5-anhydro-2-deoxy-D-mannitol	A,B	2VLC	0.73
AGL	4,6-DIDEOXY-4-AMINO-ALPHA-D-GLUCOSE	A	1CPU	0.94
AGL	4,6-DIDEOXY-4-AMINO-ALPHA-D-GLUCOSE	A	1NM9	0.94
AGL	4,6-DIDEOXY-4-AMINO-ALPHA-D-GLUCOSE	A	1MFV	0.94
AGL	4,6-DIDEOXY-4-AMINO-ALPHA-D-GLUCOSE	A	1PIG	0.94
AGL	4,6-DIDEOXY-4-AMINO-ALPHA-D-GLUCOSE	X	1Z32	0.94
AGL	4,6-DIDEOXY-4-AMINO-ALPHA-D-GLUCOSE	A	1MFU	0.94
AGL	4,6-DIDEOXY-4-AMINO-ALPHA-D-GLUCOSE	A	3BLK	0.94
AGL	4,6-DIDEOXY-4-AMINO-ALPHA-D-GLUCOSE	X	3BLP	0.94
AGL	4,6-DIDEOXY-4-AMINO-ALPHA-D-GLUCOSE	A	3DHP	0.94
3MG	3-O-methyl-beta-D-glucopyranose	A	2QW1	0.7
ABD	ACARBOSE DERIVED HEXASACCHARIDE	A	1QHO	0.7
A2G	N-ACETYL-2-DEOXY-2-AMINO-GALACTOSE	A,B,C,D	2E51	0.73
A2G	N-ACETYL-2-DEOXY-2-AMINO-GALACTOSE	A	1D0H	0.73
A2G	N-ACETYL-2-DEOXY-2-AMINO-GALACTOSE	A	1JOT	0.73
A2G	N-ACETYL-2-DEOXY-2-AMINO-GALACTOSE	A	1LLP	0.73
A2G	N-ACETYL-2-DEOXY-2-AMINO-GALACTOSE	X,Y	2EAL	0.73
A2G	N-ACETYL-2-DEOXY-2-AMINO-GALACTOSE	A,B	1LU2	0.73
A2G	N-ACETYL-2-DEOXY-2-AMINO-GALACTOSE	A,B,C,E,F	2J3F	0.73
A2G	N-ACETYL-2-DEOXY-2-AMINO-GALACTOSE	A	1LU1	0.73
A2G	N-ACETYL-2-DEOXY-2-AMINO-GALACTOSE	D,E,F,G,H,I, J,K,L,M	3EFX	0.73
A2G	N-ACETYL-2-DEOXY-2-AMINO-GALACTOSE	A	2VMC	0.73
A2G	N-ACETYL-2-DEOXY-2-AMINO-GALACTOSE	A,B	2W7Y	0.73
A2G	N-ACETYL-2-DEOXY-2-AMINO-GALACTOSE	A	1FNZ	0.73
A2G	N-ACETYL-2-DEOXY-2-AMINO-GALACTOSE	A,B,C,D	2W1U	0.73
A2G	N-ACETYL-2-DEOXY-2-AMINO-GALACTOSE	F	2JHI	0.73
A2G	N-ACETYL-2-DEOXY-2-AMINO-GALACTOSE	A,C,E,G	1M26	0.73
A2G	N-ACETYL-2-DEOXY-2-AMINO-GALACTOSE	A,B,C,D	2DTY	0.73
A2G	N-ACETYL-2-DEOXY-2-AMINO-GALACTOSE	A,B	2J1U	0.73
A2G	N-ACETYL-2-DEOXY-2-AMINO-GALACTOSE	A	2CCV	0.73
A2G	N-ACETYL-2-DEOXY-2-AMINO-GALACTOSE	A	2A2D	0.73
A2G	N-ACETYL-2-DEOXY-2-AMINO-GALACTOSE	A	2AYS	0.73
A2G	N-ACETYL-2-DEOXY-2-AMINO-GALACTOSE	A,B,C,D	2ZUT	0.73
A2G	N-ACETYL-2-DEOXY-2-AMINO-GALACTOSE	A	1KYJ	0.73
A2G	N-ACETYL-2-DEOXY-2-AMINO-GALACTOSE	A,B	2VNG	0.73
A2G	N-ACETYL-2-DEOXY-2-AMINO-GALACTOSE	A,B	2Z48	0.73
A2G	N-ACETYL-2-DEOXY-2-AMINO-GALACTOSE	1,2,3	1BCH	0.73
A2G	N-ACETYL-2-DEOXY-2-AMINO-GALACTOSE	A	2K33	0.73
A2G	N-ACETYL-2-DEOXY-2-AMINO-GALACTOSE	A	2IXB	0.73
A2G	N-ACETYL-2-DEOXY-2-AMINO-GALACTOSE	A,B	1ULF	0.73
A2G	N-ACETYL-2-DEOXY-2-AMINO-GALACTOSE	A,B	1JLX	0.73
A2G	N-ACETYL-2-DEOXY-2-AMINO-GALACTOSE	A	1AX0	0.73
A2G	N-ACETYL-2-DEOXY-2-AMINO-GALACTOSE	A	3CA3	0.73
A2G	N-ACETYL-2-DEOXY-2-AMINO-GALACTOSE	A,B,C,D	1WMZ	0.73
A2G	N-ACETYL-2-DEOXY-2-AMINO-GALACTOSE	A	3CA6	0.73
A2G	N-ACETYL-2-DEOXY-2-AMINO-GALACTOSE	D,E,G,H	1LTI	0.73
A2G	N-ACETYL-2-DEOXY-2-AMINO-GALACTOSE	A,B,C,D	2E7T	0.73
A2G	N-ACETYL-2-DEOXY-2-AMINO-GALACTOSE	N,O,P,Q,R,S, T,U,V,W	2O2L	0.73
2TB	1,3-DIAMINO-4,5,6-TRIHYDROXY-CYCLOHEXANE	A	2TOB	0.7
1GL	4-O-METHYL-2,6-DIDEOXY-ALPHA-D- GALACTO-HEXOPYRANOSE	A,B,C,D	1VAQ	0.7
1GL	4-O-METHYL-2,6-DIDEOXY-ALPHA-D- GALACTO-HEXOPYRANOSE	A,B	1EKH	0.7
1GL	4-O-METHYL-2,6-DIDEOXY-ALPHA-D- GALACTO-HEXOPYRANOSE	A,B	1EKI	0.7
1GL	4-O-METHYL-2,6-DIDEOXY-ALPHA-D- GALACTO-HEXOPYRANOSE	A,B	1D83	0.7
9CS	(1R,2S,3S,4R,6S)-4,6-DIAMINO-3- [(3-AMINO-3-DEOXY-ALPHA-D-GLUCOPYRANOSYL)OXY]- 2-HYDROXYCYCLOHEXYL 2,6-DIAMINO- 2,6-DIDEOXY-ALPHA-D-GLUCOPYRANOSIDE	A	2QIR	0.79
ABL	6-HYDROXYMETHYL-5-(3,4,5-TRIHYDROXY- 6-HYDROXYMETHYL-TETRAHYDRO-PYRAN- 2-YLOXY)-PIPERIDINE-2,3,4-TRIOL	A,B	1NAA	0.78
ABL	6-HYDROXYMETHYL-5-(3,4,5-TRIHYDROXY- 6-HYDROXYMETHYL-TETRAHYDRO-PYRAN- 2-YLOXY)-PIPERIDINE-2,3,4-TRIOL	A	2AXR	0.78
AOG	4-AMINO-2-OCTYLOXY-6-HYDROXYMETHYL- TETRAHYDRO-PYRAN-3,5-DIOL	A	1R82	0.94
1GN	2-DEOXY-2-AMINOGALACTOSE	A,B	3GAL	0.88
AMG	ALPHA-METHYL-D-GALACTOSIDE	A,C,E,G	1TP8	0.74
AMG	ALPHA-METHYL-D-GALACTOSIDE	A,B,C,D	1BXH	0.74
AMG	ALPHA-METHYL-D-GALACTOSIDE	A,C,E,G	1WS4	0.74
AMG	ALPHA-METHYL-D-GALACTOSIDE	A,B,C,D,E,F, G,H	1FAY	0.74
AMG	ALPHA-METHYL-D-GALACTOSIDE	A	3CA5	0.74
AMG	ALPHA-METHYL-D-GALACTOSIDE	A,C,E,G	1UH1	0.74
AMG	ALPHA-METHYL-D-GALACTOSIDE	A,B	1F9K	0.74
AMG	ALPHA-METHYL-D-GALACTOSIDE	A,B	2Z49	0.74
AMG	ALPHA-METHYL-D-GALACTOSIDE	A,C,E,G	1TOQ	0.74
AMG	ALPHA-METHYL-D-GALACTOSIDE	A,B,C,D	1WBL	0.74
AMG	ALPHA-METHYL-D-GALACTOSIDE	A,C,E,G	1JAC	0.74
2GS	2-O-METHYL-ALPHA-D-GALACTOPYRANOSE	A,B,C,D	2DTW	0.72
AR4	2-AMINO-5-(3-FLUORO-3,4-DIHYDROXY- 5-HYDROXYMETHYL-TETRAHYDRO-FURAN- 2-YLOXY)-5-HYDROXY-PENTANOIC ACID	A,B,C	1S2D	0.71
AD7	octyl 3-amino-3-deoxy-2-O-(2,6- dideoxy-alpha-L-lyxo-hexopyranosyl)- beta-D-galactopyranoside	A	2RJ9	0.86
AD7	octyl 3-amino-3-deoxy-2-O-(2,6- dideoxy-alpha-L-lyxo-hexopyranosyl)- beta-D-galactopyranoside	A	2RJ4	0.86
ABE	ABEQUOSE	H,L	1MFE	0.7
ABE	ABEQUOSE	H	1MFA	0.7
ABE	ABEQUOSE	A,B,C	2J60	0.7
ABE	ABEQUOSE	H	1MFC	0.7
ABE	ABEQUOSE	H	1MFD	0.7
ABE	ABEQUOSE	H	1MFB	0.7
ABE	ABEQUOSE	A	1TYX	0.7
AIG	4-AMINO-2-HEXYLOXY-6-HYDROXYMETHYL- TETRAHYDRO-PYRAN-3,5-DIOL	A	1R7Y	0.98
AIG	4-AMINO-2-HEXYLOXY-6-HYDROXYMETHYL- TETRAHYDRO-PYRAN-3,5-DIOL	A	1R7X	0.98
AIG	4-AMINO-2-HEXYLOXY-6-HYDROXYMETHYL- TETRAHYDRO-PYRAN-3,5-DIOL	A	1R81	0.98
AIG	4-AMINO-2-HEXYLOXY-6-HYDROXYMETHYL- TETRAHYDRO-PYRAN-3,5-DIOL	A	1R7V	0.98
AIG	4-AMINO-2-HEXYLOXY-6-HYDROXYMETHYL- TETRAHYDRO-PYRAN-3,5-DIOL	A	1R80	0.98
B7G	HEPTYL-BETA-D-GLUCOPYRANOSIDE	A,B	1Y0S	0.72
B7G	HEPTYL-BETA-D-GLUCOPYRANOSIDE	A,B	2B50	0.72
B7G	HEPTYL-BETA-D-GLUCOPYRANOSIDE	A,B	2ZNP	0.72
B7G	HEPTYL-BETA-D-GLUCOPYRANOSIDE	A,B	2AWH	0.72
B7G	HEPTYL-BETA-D-GLUCOPYRANOSIDE	A,B	2ZNQ	0.72
B7G	HEPTYL-BETA-D-GLUCOPYRANOSIDE	A	3GZ9	0.72
B7G	HEPTYL-BETA-D-GLUCOPYRANOSIDE	A,D	1QPF	0.72
B7G	HEPTYL-BETA-D-GLUCOPYRANOSIDE	A,B	2BAW	0.72
AMV	METHYL 2-(ACETYLAMINO)-3-O-[(1R)- 1-CARBOXYETHYL]-2-DEOXY-BETA-D- GLUCOPYRANOSIDE	A	2J8G	0.71
AMV	METHYL 2-(ACETYLAMINO)-3-O-[(1R)- 1-CARBOXYETHYL]-2-DEOXY-BETA-D- GLUCOPYRANOSIDE	A	2J8F	0.71