MMsInc Molecule/ Ligand PDB

Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02398152

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
MYG	GLUCOSAMINYL-(ALPHA-6)-D-MYO-INOSITOL	A	1GYM	0.76
NBV	(2R,3R,4R,5S)-1-BUTYL-2-(HYDROXYMETHYL)PIPERIDINE- 3,4,5-TRIOL	A,B	2V3D	0.71
TOC	2,3,6-TRIDEOXY-2,6-DIAMINO GLUCOSE	A	2TOB	0.73
TOC	2,3,6-TRIDEOXY-2,6-DIAMINO GLUCOSE	A	1TOB	0.73
GLP	GLUCOSAMINE 6-PHOSPHATE	E,F,G,H,P,Q, R,S	2NZ4	0.74
GLP	GLUCOSAMINE 6-PHOSPHATE	A	1MOQ	0.74
GLP	GLUCOSAMINE 6-PHOSPHATE	A	3CXQ	0.74
GLP	GLUCOSAMINE 6-PHOSPHATE	A,B	3B4A	0.74
GLP	GLUCOSAMINE 6-PHOSPHATE	A,B	3B4C	0.74
GLP	GLUCOSAMINE 6-PHOSPHATE	A,B	3B4B	0.74
GLP	GLUCOSAMINE 6-PHOSPHATE	A,B	2VHL	0.74
GLP	GLUCOSAMINE 6-PHOSPHATE	A,B	2Z75	0.74
GLP	GLUCOSAMINE 6-PHOSPHATE	X	2VF5	0.74
GLP	GLUCOSAMINE 6-PHOSPHATE	A,B	2RI1	0.74
1GN	2-DEOXY-2-AMINOGALACTOSE	A,B	3GAL	0.82
AGL	4,6-DIDEOXY-4-AMINO-ALPHA-D-GLUCOSE	A	1CPU	0.76
AGL	4,6-DIDEOXY-4-AMINO-ALPHA-D-GLUCOSE	A	1NM9	0.76
AGL	4,6-DIDEOXY-4-AMINO-ALPHA-D-GLUCOSE	A	1MFV	0.76
AGL	4,6-DIDEOXY-4-AMINO-ALPHA-D-GLUCOSE	A	1PIG	0.76
AGL	4,6-DIDEOXY-4-AMINO-ALPHA-D-GLUCOSE	X	1Z32	0.76
AGL	4,6-DIDEOXY-4-AMINO-ALPHA-D-GLUCOSE	A	1MFU	0.76
AGL	4,6-DIDEOXY-4-AMINO-ALPHA-D-GLUCOSE	A	3BLK	0.76
AGL	4,6-DIDEOXY-4-AMINO-ALPHA-D-GLUCOSE	X	3BLP	0.76
AGL	4,6-DIDEOXY-4-AMINO-ALPHA-D-GLUCOSE	A	3DHP	0.76
PA2	PAROMOMYCIN (RING 2)	B	1O9M	0.87
PA2	PAROMOMYCIN (RING 2)	A	1PBR	0.87
NOJ	1-DEOXYNOJIRIMYCIN	A,B	1OIM	0.82
NOJ	1-DEOXYNOJIRIMYCIN	A,B	2J77	0.82
NOJ	1-DEOXYNOJIRIMYCIN	A,B	2JKE	0.82
NOJ	1-DEOXYNOJIRIMYCIN	A	3GBE	0.82
NOJ	1-DEOXYNOJIRIMYCIN	A,B	3GXT	0.82
NOJ	1-DEOXYNOJIRIMYCIN	A,B	1DIE	0.82
NOJ	1-DEOXYNOJIRIMYCIN	A	1DOG	0.82
NOJ	1-DEOXYNOJIRIMYCIN	A,B	1I75	0.82
NOJ	1-DEOXYNOJIRIMYCIN	A,B	2PWD	0.82
DMJ	1-DEOXYMANNOJIRIMYCIN	A,B	1KRE	0.82
DMJ	1-DEOXYMANNOJIRIMYCIN	A	1FO2	0.82
DMJ	1-DEOXYMANNOJIRIMYCIN	A	1G6I	0.82
DMJ	1-DEOXYMANNOJIRIMYCIN	A	1HXK	0.82
DAG	4,6-DIDEOXY-4-AMINO-BETA-D-GLUCOPYRANOSIDE	A	2PIK	0.76
DAG	4,6-DIDEOXY-4-AMINO-BETA-D-GLUCOPYRANOSIDE	A	6CGT	0.76
DAG	4,6-DIDEOXY-4-AMINO-BETA-D-GLUCOPYRANOSIDE	A,B	1PIK	0.76
SGN	N,O6-DISULFO-GLUCOSAMINE	A,B	1FQ9	0.74
SGN	N,O6-DISULFO-GLUCOSAMINE	B	2AXM	0.74
SGN	N,O6-DISULFO-GLUCOSAMINE	A,B	1GMN	0.74
SGN	N,O6-DISULFO-GLUCOSAMINE	A,B	1T8U	0.74
SGN	N,O6-DISULFO-GLUCOSAMINE	A	1BFB	0.74
SGN	N,O6-DISULFO-GLUCOSAMINE	B,D,F,H	1XMN	0.74
SGN	N,O6-DISULFO-GLUCOSAMINE	A,B,C,D,E,F, G,H	1GMO	0.74
SGN	N,O6-DISULFO-GLUCOSAMINE	A,B,C,D,E,F	1AXM	0.74
SGN	N,O6-DISULFO-GLUCOSAMINE	A	1XT3	0.74
SGN	N,O6-DISULFO-GLUCOSAMINE	1	1QQP	0.74
SGN	N,O6-DISULFO-GLUCOSAMINE	A,B	1RID	0.74
SGN	N,O6-DISULFO-GLUCOSAMINE	A	1G5N	0.74
SGN	N,O6-DISULFO-GLUCOSAMINE	A,B	2BRS	0.74
SGN	N,O6-DISULFO-GLUCOSAMINE	A	1HPN	0.74
SGN	N,O6-DISULFO-GLUCOSAMINE	A	1ZA4	0.74
SGN	N,O6-DISULFO-GLUCOSAMINE	1	1ZBA	0.74
SGN	N,O6-DISULFO-GLUCOSAMINE	A	1BFC	0.74
SGN	N,O6-DISULFO-GLUCOSAMINE	A,B,C,D	2VRA	0.74
SGN	N,O6-DISULFO-GLUCOSAMINE	A	2HYV	0.74
SGN	N,O6-DISULFO-GLUCOSAMINE	H,I	3B9F	0.74
SGN	N,O6-DISULFO-GLUCOSAMINE	A,B	3DY0	0.74
SGN	N,O6-DISULFO-GLUCOSAMINE	A	2HYU	0.74
SGN	N,O6-DISULFO-GLUCOSAMINE	B,C,D,E	1E0O	0.74
BDG	O-2,6-DIAMINO-2,6-DIDEOXY-ALPHA- D-GLUCOPYRANOSE	A	1QD3	0.78
BDG	O-2,6-DIAMINO-2,6-DIDEOXY-ALPHA- D-GLUCOPYRANOSE	B	1O9M	0.78
BDG	O-2,6-DIAMINO-2,6-DIDEOXY-ALPHA- D-GLUCOPYRANOSE	A	1NEM	0.78
GP1	GLUCOSAMINE 1-PHOSPHATE	A,B,C	1Q9W	0.74
GP1	GLUCOSAMINE 1-PHOSPHATE	A,B	2OI6	0.74
GP1	GLUCOSAMINE 1-PHOSPHATE	A	2FCP	0.74
GP1	GLUCOSAMINE 1-PHOSPHATE	A	1FCP	0.74
GP1	GLUCOSAMINE 1-PHOSPHATE	A	1UJW	0.74
TOB	1,3-DIAMINO-5,6-DIHYDROXYCYCLOHEXANE	A	1TOB	0.85
2TB	1,3-DIAMINO-4,5,6-TRIHYDROXY-CYCLOHEXANE	A	2TOB	0.91
MSN	(1R,2R,3R,4S,5R)-4-AMINO-5-(METHYLTHIO)CYCLOPENTANE- 1,2,3-TRIOL	A	2F7O	0.71
MSN	(1R,2R,3R,4S,5R)-4-AMINO-5-(METHYLTHIO)CYCLOPENTANE- 1,2,3-TRIOL	A	3DX0	0.71
GCN	3-DEOXY-D-GLUCOSAMINE	A	1FI1	0.82
GCN	3-DEOXY-D-GLUCOSAMINE	A	1QFG	0.82
GCN	3-DEOXY-D-GLUCOSAMINE	A	1QKC	0.82
GCN	3-DEOXY-D-GLUCOSAMINE	A,B	2GRX	0.82
GCN	3-DEOXY-D-GLUCOSAMINE	A	1QJQ	0.82
GCN	3-DEOXY-D-GLUCOSAMINE	A	1QFF	0.82
GP4	GLUCOSAMINE 4-PHOSPHATE	A	1FCP	0.74
GP4	GLUCOSAMINE 4-PHOSPHATE	A,B,C	1Q9W	0.74
GP4	GLUCOSAMINE 4-PHOSPHATE	A	2FCP	0.74
LKA	5-THIO-A/B-D-MANNOPYRANOSYLAMINE	A	1R33	0.75
GE2	3,5-DIAMINO-CYCLOHEXANOL	A	1BYJ	0.78
AOL	(1R,2R,3S,4S,5R)-5-AMINOCYCLOPENTANE- 1,2,3,4-TETROL	A	2F7Q	0.85
TOA	3-DEOXY-3-AMINO GLUCOSE	A	1TOB	0.79
TOA	3-DEOXY-3-AMINO GLUCOSE	A	2TOB	0.79
YTB	(1R,2R,3S,4R,5R)-5-aminocyclopentane- 1,2,3,4-tetrol	A	3DX3	0.85
GNS	N-SULFO-ALPHA-D-GLUCOSAMINE	A	2ERM	0.75
MMN	5-DEOXY-5-{[(1S)-1-HYDROXYETHYL]AMINO}- D-GLUCITOL	A	1XUZ	0.79
AZF	AZAFAGOMINE	A,B	2J7H	0.72
GDA	4-DEOXY-4-AMINO-BETA-D-GLUCOSE	A,B	1OCB	0.77
DQQ	2,5-DIDEOXY-2,5-IMINO-D-MANNITOL	A	2AEY	0.77
XXX	(2R,3S,4R,5R,6R)-6-((1R,2R,3S,4R,6S)- 4,6-DIAMINO-2,3-DIHYDROXYCYCLOHEXYLOXY)- 5-AMINO-2-(AMINOMETHYL)-TETRAHYDRO- 2H-PYRAN-3,4-DIOL	B	2F4S	0.74
XXX	(2R,3S,4R,5R,6R)-6-((1R,2R,3S,4R,6S)- 4,6-DIAMINO-2,3-DIHYDROXYCYCLOHEXYLOXY)- 5-AMINO-2-(AMINOMETHYL)-TETRAHYDRO- 2H-PYRAN-3,4-DIOL	A,B	2FCX	0.74
XXX	(2R,3S,4R,5R,6R)-6-((1R,2R,3S,4R,6S)- 4,6-DIAMINO-2,3-DIHYDROXYCYCLOHEXYLOXY)- 5-AMINO-2-(AMINOMETHYL)-TETRAHYDRO- 2H-PYRAN-3,4-DIOL	B	2ET8	0.74
CYY	2-DEOXYSTREPTAMINE	A	1QD3	0.93
IDG	O-2,6-DIAMINO-2,6-DIDEOXY-BETA- L-IDOPYRANOSE	A	1QD3	0.78
IDG	O-2,6-DIAMINO-2,6-DIDEOXY-BETA- L-IDOPYRANOSE	A	1NEM	0.78
IDG	O-2,6-DIAMINO-2,6-DIDEOXY-BETA- L-IDOPYRANOSE	A	1PBR	0.78
CGF	C-(1-AZIDO-ALPHA-D-GLUCOPYRANOSYL) FORMAMIDE	A	1P4G	0.75
GCS	D-GLUCOSAMINE	A	3CO4	0.82
GCS	D-GLUCOSAMINE	A	1QGI	0.82
GCS	D-GLUCOSAMINE	A,B	2VZS	0.82
GCS	D-GLUCOSAMINE	A	1E9L	0.82
GCS	D-GLUCOSAMINE	A,B,C,D	3FXI	0.82
GCS	D-GLUCOSAMINE	A,B	2VZV	0.82
OXZ	TETRAHYDROOXAZINE	A,B	1W3J	0.77
OXZ	TETRAHYDROOXAZINE	A	1W3K	0.77
OXZ	TETRAHYDROOXAZINE	A	1W3L	0.77
M6R	5-AMINO-5-DEOXY-1-O-PHOSPHONO-D- MANNITOL	A,B,C,D	2PUV	0.83
PA1	PAROMOMYCIN (RING 1)	A	1PBR	0.82
PA1	PAROMOMYCIN (RING 1)	A	1QKC	0.82
PA1	PAROMOMYCIN (RING 1)	A	1QFG	0.82
PA1	PAROMOMYCIN (RING 1)	A	1FI1	0.82
PA1	PAROMOMYCIN (RING 1)	A,B,C,D	3FXI	0.82
PA1	PAROMOMYCIN (RING 1)	A	1QFF	0.82
AGP	2-DEOXY-2-AMINO GLUCITOL-6-PHOSPHATE	A,B,C,D,E,F	1NE7	0.83
AGP	2-DEOXY-2-AMINO GLUCITOL-6-PHOSPHATE	A	2ZJ4	0.83
AGP	2-DEOXY-2-AMINO GLUCITOL-6-PHOSPHATE	A	1MOS	0.83
AGP	2-DEOXY-2-AMINO GLUCITOL-6-PHOSPHATE	A,B	1HOR	0.83
DFU	(2S,3R,4S,5R)-2-METHYLPIPERIDINE- 3,4,5-TRIOL	A,B	2EAC	0.72
YHO	(1S,2S,3R,4R)-4-aminocyclopentane- 1,2,3-triol	A	3DX1	0.83
DIG	2,5-DIDEOXY-2,5-IMINO-D-GLUCITOL	A,B	1DID	0.77
GOO	(1R,2R,3R,4S,5R)-4-amino-5-methoxycyclopentane- 1,2,3-triol	A	3DX4	0.78
IMR	IMINORIBITOL	A,B,C	1I80	0.7
AIG	4-AMINO-2-HEXYLOXY-6-HYDROXYMETHYL- TETRAHYDRO-PYRAN-3,5-DIOL	A	1R7Y	0.73
AIG	4-AMINO-2-HEXYLOXY-6-HYDROXYMETHYL- TETRAHYDRO-PYRAN-3,5-DIOL	A	1R7X	0.73
AIG	4-AMINO-2-HEXYLOXY-6-HYDROXYMETHYL- TETRAHYDRO-PYRAN-3,5-DIOL	A	1R81	0.73
AIG	4-AMINO-2-HEXYLOXY-6-HYDROXYMETHYL- TETRAHYDRO-PYRAN-3,5-DIOL	A	1R7V	0.73
AIG	4-AMINO-2-HEXYLOXY-6-HYDROXYMETHYL- TETRAHYDRO-PYRAN-3,5-DIOL	A	1R80	0.73
1AB	1,4-DIDEOXY-1,4-IMINO-D-ARABINITOL	A	2G9Q	0.7
NEB	2-DEOXY-D-STREPTAMINE	A	1NEM	0.93
CGB	CALYSTEGINE B2	A,B	2CBV	0.75