MMsInc Molecule/ Ligand PDB

Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03854290

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
TOY	TOBRAMYCIN	A,B	1M4D	0.71
TOY	TOBRAMYCIN	A,B	1LC4	0.71
RIO	RIBOSTAMYCIN	A,B	1M4G	0.71
RIO	RIBOSTAMYCIN	A,B	3C3Z	0.71
RIO	RIBOSTAMYCIN	A,B	1S3Z	0.71
RIO	RIBOSTAMYCIN	A,B,C,D	2FCZ	0.71
RIO	RIBOSTAMYCIN	A,B	2ET5	0.71
RIO	RIBOSTAMYCIN	A,B	3DVV	0.71
RIO	RIBOSTAMYCIN	A	2BUE	0.71
IDG	O-2,6-DIAMINO-2,6-DIDEOXY-BETA- L-IDOPYRANOSE	A	1QD3	0.88
IDG	O-2,6-DIAMINO-2,6-DIDEOXY-BETA- L-IDOPYRANOSE	A	1NEM	0.88
IDG	O-2,6-DIAMINO-2,6-DIDEOXY-BETA- L-IDOPYRANOSE	A	1PBR	0.88
N33		A	2O3V	0.71
GLP	GLUCOSAMINE 6-PHOSPHATE	E,F,G,H,P,Q, R,S	2NZ4	0.75
GLP	GLUCOSAMINE 6-PHOSPHATE	A	1MOQ	0.75
GLP	GLUCOSAMINE 6-PHOSPHATE	A	3CXQ	0.75
GLP	GLUCOSAMINE 6-PHOSPHATE	A,B	3B4A	0.75
GLP	GLUCOSAMINE 6-PHOSPHATE	A,B	3B4C	0.75
GLP	GLUCOSAMINE 6-PHOSPHATE	A,B	3B4B	0.75
GLP	GLUCOSAMINE 6-PHOSPHATE	A,B	2VHL	0.75
GLP	GLUCOSAMINE 6-PHOSPHATE	A,B	2Z75	0.75
GLP	GLUCOSAMINE 6-PHOSPHATE	X	2VF5	0.75
GLP	GLUCOSAMINE 6-PHOSPHATE	A,B	2RI1	0.75
GP4	GLUCOSAMINE 4-PHOSPHATE	A	1FCP	0.75
GP4	GLUCOSAMINE 4-PHOSPHATE	A,B,C	1Q9W	0.75
GP4	GLUCOSAMINE 4-PHOSPHATE	A	2FCP	0.75
MUR	MURAMIC ACID	A,C,E,G	1LOD	0.71
GCS	D-GLUCOSAMINE	A	3CO4	0.84
GCS	D-GLUCOSAMINE	A	1QGI	0.84
GCS	D-GLUCOSAMINE	A,B	2VZS	0.84
GCS	D-GLUCOSAMINE	A	1E9L	0.84
GCS	D-GLUCOSAMINE	A,B,C,D	3FXI	0.84
GCS	D-GLUCOSAMINE	A,B	2VZV	0.84
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	0.76
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	0.76
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	0.76
B6D	2,4-bis(acetylamino)-2,4,6-trideoxy- beta-D-glucopyranose	A	2K33	0.75
B6D	2,4-bis(acetylamino)-2,4,6-trideoxy- beta-D-glucopyranose	A,B	3FIR	0.75
PA1	PAROMOMYCIN (RING 1)	A	1PBR	0.84
PA1	PAROMOMYCIN (RING 1)	A	1QKC	0.84
PA1	PAROMOMYCIN (RING 1)	A	1QFG	0.84
PA1	PAROMOMYCIN (RING 1)	A	1FI1	0.84
PA1	PAROMOMYCIN (RING 1)	A,B,C,D	3FXI	0.84
PA1	PAROMOMYCIN (RING 1)	A	1QFF	0.84
KNC	KANAMYCIN C	A	1V0C	0.71
GNS	N-SULFO-ALPHA-D-GLUCOSAMINE	A	2ERM	0.76
GP1	GLUCOSAMINE 1-PHOSPHATE	A,B,C	1Q9W	0.75
GP1	GLUCOSAMINE 1-PHOSPHATE	A,B	2OI6	0.75
GP1	GLUCOSAMINE 1-PHOSPHATE	A	2FCP	0.75
GP1	GLUCOSAMINE 1-PHOSPHATE	A	1FCP	0.75
GP1	GLUCOSAMINE 1-PHOSPHATE	A	1UJW	0.75
SGN	N,O6-DISULFO-GLUCOSAMINE	A,B	1FQ9	0.75
SGN	N,O6-DISULFO-GLUCOSAMINE	B	2AXM	0.75
SGN	N,O6-DISULFO-GLUCOSAMINE	A,B	1GMN	0.75
SGN	N,O6-DISULFO-GLUCOSAMINE	A,B	1T8U	0.75
SGN	N,O6-DISULFO-GLUCOSAMINE	A	1BFB	0.75
SGN	N,O6-DISULFO-GLUCOSAMINE	B,D,F,H	1XMN	0.75
SGN	N,O6-DISULFO-GLUCOSAMINE	A,B,C,D,E,F, G,H	1GMO	0.75
SGN	N,O6-DISULFO-GLUCOSAMINE	A,B,C,D,E,F	1AXM	0.75
SGN	N,O6-DISULFO-GLUCOSAMINE	A	1XT3	0.75
SGN	N,O6-DISULFO-GLUCOSAMINE	1	1QQP	0.75
SGN	N,O6-DISULFO-GLUCOSAMINE	A,B	1RID	0.75
SGN	N,O6-DISULFO-GLUCOSAMINE	A	1G5N	0.75
SGN	N,O6-DISULFO-GLUCOSAMINE	A,B	2BRS	0.75
SGN	N,O6-DISULFO-GLUCOSAMINE	A	1HPN	0.75
SGN	N,O6-DISULFO-GLUCOSAMINE	A	1ZA4	0.75
SGN	N,O6-DISULFO-GLUCOSAMINE	1	1ZBA	0.75
SGN	N,O6-DISULFO-GLUCOSAMINE	A	1BFC	0.75
SGN	N,O6-DISULFO-GLUCOSAMINE	A,B,C,D	2VRA	0.75
SGN	N,O6-DISULFO-GLUCOSAMINE	A	2HYV	0.75
SGN	N,O6-DISULFO-GLUCOSAMINE	H,I	3B9F	0.75
SGN	N,O6-DISULFO-GLUCOSAMINE	A,B	3DY0	0.75
SGN	N,O6-DISULFO-GLUCOSAMINE	A	2HYU	0.75
SGN	N,O6-DISULFO-GLUCOSAMINE	B,C,D,E	1E0O	0.75
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	0.71
GE1	3,4-DIDEOXY-2,6-AMINO-ALPHA-D GALACTOPYRANOSE	A	1BYJ	1
KAN	KANAMYCIN A	A	1L8T	0.71
KAN	KANAMYCIN A	A,B	1M4I	0.71
KAN	KANAMYCIN A	A,B	1ND4	0.71
KAN	KANAMYCIN A	A,B	1KNY	0.71
KAN	KANAMYCIN A	A,B	2ESI	0.71
TOC	2,3,6-TRIDEOXY-2,6-DIAMINO GLUCOSE	A	2TOB	0.9
TOC	2,3,6-TRIDEOXY-2,6-DIAMINO GLUCOSE	A	1TOB	0.9
AIG	4-AMINO-2-HEXYLOXY-6-HYDROXYMETHYL- TETRAHYDRO-PYRAN-3,5-DIOL	A	1R7Y	0.77
AIG	4-AMINO-2-HEXYLOXY-6-HYDROXYMETHYL- TETRAHYDRO-PYRAN-3,5-DIOL	A	1R7X	0.77
AIG	4-AMINO-2-HEXYLOXY-6-HYDROXYMETHYL- TETRAHYDRO-PYRAN-3,5-DIOL	A	1R81	0.77
AIG	4-AMINO-2-HEXYLOXY-6-HYDROXYMETHYL- TETRAHYDRO-PYRAN-3,5-DIOL	A	1R7V	0.77
AIG	4-AMINO-2-HEXYLOXY-6-HYDROXYMETHYL- TETRAHYDRO-PYRAN-3,5-DIOL	A	1R80	0.77
1GN	2-DEOXY-2-AMINOGALACTOSE	A,B	3GAL	0.84
AOG	4-AMINO-2-OCTYLOXY-6-HYDROXYMETHYL- TETRAHYDRO-PYRAN-3,5-DIOL	A	1R82	0.74
MAT	2,4-DIDEOXY-4-[2-(PROPYL)AMINO]- 3-O-METHYL ALPHA-L-THREO-PENTOPYRANOSIDE	A,B	1PIK	0.76
NEB	2-DEOXY-D-STREPTAMINE	A	1NEM	0.72
PA2	PAROMOMYCIN (RING 2)	B	1O9M	0.7
PA2	PAROMOMYCIN (RING 2)	A	1PBR	0.7
EMP	2,4-DIDEOXY-4-(ETHYLAMINO)-3-O- METHYL ALPHA-L-THREO-PENTOPYRANOSIDE	A	2PIK	0.76
2TB	1,3-DIAMINO-4,5,6-TRIHYDROXY-CYCLOHEXANE	A	2TOB	0.71
BDG	O-2,6-DIAMINO-2,6-DIDEOXY-ALPHA- D-GLUCOPYRANOSE	A	1QD3	0.88
BDG	O-2,6-DIAMINO-2,6-DIDEOXY-ALPHA- D-GLUCOPYRANOSE	B	1O9M	0.88
BDG	O-2,6-DIAMINO-2,6-DIDEOXY-ALPHA- D-GLUCOPYRANOSE	A	1NEM	0.88
TOA	3-DEOXY-3-AMINO GLUCOSE	A	1TOB	0.83
TOA	3-DEOXY-3-AMINO GLUCOSE	A	2TOB	0.83
GDA	4-DEOXY-4-AMINO-BETA-D-GLUCOSE	A,B	1OCB	0.85
MYG	GLUCOSAMINYL-(ALPHA-6)-D-MYO-INOSITOL	A	1GYM	0.75
DAG	4,6-DIDEOXY-4-AMINO-BETA-D-GLUCOPYRANOSIDE	A	2PIK	0.84
DAG	4,6-DIDEOXY-4-AMINO-BETA-D-GLUCOPYRANOSIDE	A	6CGT	0.84
DAG	4,6-DIDEOXY-4-AMINO-BETA-D-GLUCOPYRANOSIDE	A,B	1PIK	0.84
N30	(1R,2R,3S,4R,6S)-4,6-DIAMINO-2- [(5-AMINO-5-DEOXY-BETA-D-RIBOFURANOSYL)OXY]- 3-HYDROXYCYCLOHEXYL 2-AMINO-2-DEOXY- ALPHA-D-GLUCOPYRANOSIDE	B	2O3X	0.71
AGL	4,6-DIDEOXY-4-AMINO-ALPHA-D-GLUCOSE	A	1CPU	0.84
AGL	4,6-DIDEOXY-4-AMINO-ALPHA-D-GLUCOSE	A	1NM9	0.84
AGL	4,6-DIDEOXY-4-AMINO-ALPHA-D-GLUCOSE	A	1MFV	0.84
AGL	4,6-DIDEOXY-4-AMINO-ALPHA-D-GLUCOSE	A	1PIG	0.84
AGL	4,6-DIDEOXY-4-AMINO-ALPHA-D-GLUCOSE	X	1Z32	0.84
AGL	4,6-DIDEOXY-4-AMINO-ALPHA-D-GLUCOSE	A	1MFU	0.84
AGL	4,6-DIDEOXY-4-AMINO-ALPHA-D-GLUCOSE	A	3BLK	0.84
AGL	4,6-DIDEOXY-4-AMINO-ALPHA-D-GLUCOSE	X	3BLP	0.84
AGL	4,6-DIDEOXY-4-AMINO-ALPHA-D-GLUCOSE	A	3DHP	0.84
GCN	3-DEOXY-D-GLUCOSAMINE	A	1FI1	0.84
GCN	3-DEOXY-D-GLUCOSAMINE	A	1QFG	0.84
GCN	3-DEOXY-D-GLUCOSAMINE	A	1QKC	0.84
GCN	3-DEOXY-D-GLUCOSAMINE	A,B	2GRX	0.84
GCN	3-DEOXY-D-GLUCOSAMINE	A	1QJQ	0.84
GCN	3-DEOXY-D-GLUCOSAMINE	A	1QFF	0.84
CYY	2-DEOXYSTREPTAMINE	A	1QD3	0.72
NNG	2-DEOXY-2-{[(S)-HYDROXY(METHYL)PHOSPHORYL]AMINO}- 6-O-PHOSPHONO-ALPHA-D-GLUCOPYRANOSE	A,B	2P53	0.7