MMsInc Molecule/ Ligand PDB

Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02478979

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
CTS	CASTANOSPERMINE	A	1EQC	0.81
CTS	CASTANOSPERMINE	A,B	2JKP	0.81
CTS	CASTANOSPERMINE	A,B,C	2VL8	0.81
CTS	CASTANOSPERMINE	A,B	2CBU	0.81
CTS	CASTANOSPERMINE	A,B	2PWG	0.81
HYG	HYGROMYCIN B	A,E,N	3DF1	0.8
HYG	HYGROMYCIN B	A,E	3DF3	0.8
HYG	HYGROMYCIN B	A,D,H,N	1HNZ	0.8
ABL	6-HYDROXYMETHYL-5-(3,4,5-TRIHYDROXY- 6-HYDROXYMETHYL-TETRAHYDRO-PYRAN- 2-YLOXY)-PIPERIDINE-2,3,4-TRIOL	A,B	1NAA	0.79
ABL	6-HYDROXYMETHYL-5-(3,4,5-TRIHYDROXY- 6-HYDROXYMETHYL-TETRAHYDRO-PYRAN- 2-YLOXY)-PIPERIDINE-2,3,4-TRIOL	A	2AXR	0.79
SWA	1S-8AB-OCTAHYDRO-INDOLIZIDINE-1A,2A,8B- TRIOL	A	1HWW	0.78
SWA	1S-8AB-OCTAHYDRO-INDOLIZIDINE-1A,2A,8B- TRIOL	A	3BLB	0.78
CNY	13,15-DIAMINO-2-(AMINOMETHYL)-3,4,9,12- TETRAHYDROXYHEXADECAHYDRO-2H-7,10- EPOXYPYRANO[2,3-B][1,10,4]BENZODIOXAZACYCLODODECIN- 8-YL 2,6-DIAMINO-2,6-DIDEOXYHEXOPYRANOSIDE	A,C,D	1ZZ5	0.76
ISX	GLUCOSE BETA-1,3-ISOFAGAMINE	A	2BVD	0.76
9MR	(3R,4R,5R)-3-HYDROXY-5-(HYDROXYMETHYL)PIPERIDIN- 4-YL BETA-D-GLUCOPYRANOSIDE	A	3CUF	0.75
9MR	(3R,4R,5R)-3-HYDROXY-5-(HYDROXYMETHYL)PIPERIDIN- 4-YL BETA-D-GLUCOPYRANOSIDE	A,B	2OYK	0.75
AM3	(3Z,5S,6R,7S,8S,8aR)-3-(octylimino)hexahydro[1,3]oxazolo[3,4- a]pyridine-5,6,7,8-tetrol	A,B,C,D	2WC3	0.75
JS4		A,B	2BEE	0.75
DR3	6-DEOXY-ALPHA-L-GLUCOPYRANOSYL- (1->2)-BETA-D-GULOPYRANOSYL-(1- >3)-2-DEOXY-2-[(1-HYDROXYETHYL)AMINO]- ALPHA-L-TALOPYRANOSE	A	1ZJ2	0.75
DR3	6-DEOXY-ALPHA-L-GLUCOPYRANOSYL- (1->2)-BETA-D-GULOPYRANOSYL-(1- >3)-2-DEOXY-2-[(1-HYDROXYETHYL)AMINO]- ALPHA-L-TALOPYRANOSE	A	1ZI5	0.75
LGS	(3Z,5S,6R,7S,8R,8aR)-3-(octylimino)hexahydro[1,3]oxazolo[3,4- a]pyridine-5,6,7,8-tetrol	A,B,C,D	2WBG	0.75
NLC	2-(ACETYLAMINO)-2-DEOXY-4-O-BETA- D-GALACTOPYRANOSYL-ALPHA-D-GLUCOPYRANOSE	A,B	2VS4	0.74
NLC	2-(ACETYLAMINO)-2-DEOXY-4-O-BETA- D-GALACTOPYRANOSYL-ALPHA-D-GLUCOPYRANOSE	A	1W3G	0.74
NLC	2-(ACETYLAMINO)-2-DEOXY-4-O-BETA- D-GALACTOPYRANOSYL-ALPHA-D-GLUCOPYRANOSE	A,B	3EHN	0.74
NLC	2-(ACETYLAMINO)-2-DEOXY-4-O-BETA- D-GALACTOPYRANOSYL-ALPHA-D-GLUCOPYRANOSE	A	1W3F	0.74
NLC	2-(ACETYLAMINO)-2-DEOXY-4-O-BETA- D-GALACTOPYRANOSYL-ALPHA-D-GLUCOPYRANOSE	A	1ZJ1	0.74
NLC	2-(ACETYLAMINO)-2-DEOXY-4-O-BETA- D-GALACTOPYRANOSYL-ALPHA-D-GLUCOPYRANOSE	A	2YY1	0.74
NLC	2-(ACETYLAMINO)-2-DEOXY-4-O-BETA- D-GALACTOPYRANOSYL-ALPHA-D-GLUCOPYRANOSE	A	1ZI3	0.74
NLC	2-(ACETYLAMINO)-2-DEOXY-4-O-BETA- D-GALACTOPYRANOSYL-ALPHA-D-GLUCOPYRANOSE	A,B	2VS3	0.74
AD7	octyl 3-amino-3-deoxy-2-O-(2,6- dideoxy-alpha-L-lyxo-hexopyranosyl)- beta-D-galactopyranoside	A	2RJ9	0.74
AD7	octyl 3-amino-3-deoxy-2-O-(2,6- dideoxy-alpha-L-lyxo-hexopyranosyl)- beta-D-galactopyranoside	A	2RJ4	0.74
AS5	2-(acetylamino)-4-O-[2-(acetylamino)- 2-deoxy-alpha-L-gulopyranosyl]- 1,5-anhydro-2-deoxy-D-mannitol	A,B	2VLC	0.73
FSM	FORSMANN ANTIGEN	A	2CGY	0.73
QPU	1,5-anhydro-4-O-(4,6-dideoxy-4- {[(1S,2S,3S,4R,5S,6R)-2,3,4,6-tetrahydroxy- 5-methylcyclohexyl]amino}-alpha- D-glucopyranosyl)-D-glucitol	A,B,C	2QPU	0.73
CBS	DI(N-ACETYL-D-GLUCOSAMINE)	A	1LJN	0.73
CBS	DI(N-ACETYL-D-GLUCOSAMINE)	A	1ZU0	0.73
CBS	DI(N-ACETYL-D-GLUCOSAMINE)	A	2HRH	0.73
CBS	DI(N-ACETYL-D-GLUCOSAMINE)	A,B	1TW5	0.73
CBS	DI(N-ACETYL-D-GLUCOSAMINE)	A,H	2HRG	0.73
CBS	DI(N-ACETYL-D-GLUCOSAMINE)	1	2BS7	0.73
CBS	DI(N-ACETYL-D-GLUCOSAMINE)	A	1C7T	0.73
CBS	DI(N-ACETYL-D-GLUCOSAMINE)	A,B	2QT6	0.73
CBS	DI(N-ACETYL-D-GLUCOSAMINE)	A	1QBB	0.73
CBS	DI(N-ACETYL-D-GLUCOSAMINE)	A	1C7S	0.73
A16	4-O-(4,6-dideoxy-4-{[(1S,2S,3S,4R,5S)- 2,3,4-trihydroxy-5-(hydroxymethyl)cyclohexyl]amino}- alpha-D-glucopyranosyl)-beta-D- glucopyranose	A,B	2VR5	0.73
JS5		A,B	2BE0	0.72
MYG	GLUCOSAMINYL-(ALPHA-6)-D-MYO-INOSITOL	A	1GYM	0.72
G2I	(3R,4R,5R)-3-hydroxy-5-(hydroxymethyl)piperidin- 4-yl 4-O-beta-D-glucopyranosyl- beta-D-glucopyranoside	A	3CUH	0.72
DR2	6-DEOXY-ALPHA-L-IDOPYRANOSYL-(1- >2)-ALPHA-D-GLUCOPYRANOSYL-(1->4)- 2-(ACETYLAMINO)-2-DEOXY-BETA-L- GULOPYRANOSE	A	3E6J	0.71
DR2	6-DEOXY-ALPHA-L-IDOPYRANOSYL-(1- >2)-ALPHA-D-GLUCOPYRANOSYL-(1->4)- 2-(ACETYLAMINO)-2-DEOXY-BETA-L- GULOPYRANOSE	A	1ZJ3	0.71
DR2	6-DEOXY-ALPHA-L-IDOPYRANOSYL-(1- >2)-ALPHA-D-GLUCOPYRANOSYL-(1->4)- 2-(ACETYLAMINO)-2-DEOXY-BETA-L- GULOPYRANOSE	A	1ZI4	0.71
PAR	PAROMOMYCIN	A	1FYP	0.71
PAR	PAROMOMYCIN	V,Z	2J02	0.71
PAR	PAROMOMYCIN	Z	2UXD	0.71
PAR	PAROMOMYCIN	A,D,N,Y,Z	1N33	0.71
PAR	PAROMOMYCIN	V,Y,Z	2WDM	0.71
PAR	PAROMOMYCIN	Y,Z	2VQE	0.71
PAR	PAROMOMYCIN	A,D,L,N	1IBK	0.71
PAR	PAROMOMYCIN	Z	2UXB	0.71
PAR	PAROMOMYCIN	Y,Z	2UU9	0.71
PAR	PAROMOMYCIN	Z	2UXC	0.71
PAR	PAROMOMYCIN	A,D,N,X	1XMQ	0.71
PAR	PAROMOMYCIN	B	2O3W	0.71
PAR	PAROMOMYCIN	V,Y,Z	2WDG	0.71
PAR	PAROMOMYCIN	A	2Z4K	0.71
PAR	PAROMOMYCIN	4,B	2Z4N	0.71
PAR	PAROMOMYCIN	V,Y,Z	2WDK	0.71
PAR	PAROMOMYCIN	A,E	2Z4M	0.71
PAR	PAROMOMYCIN	A,B,C,D	3BNQ	0.71
PAR	PAROMOMYCIN	Y,Z	2UUB	0.71
PAR	PAROMOMYCIN	A,D,H,N	1FJG	0.71
PAR	PAROMOMYCIN	A,B	1J7T	0.71
PAR	PAROMOMYCIN	Y,Z	2UUA	0.71
PAR	PAROMOMYCIN	Y,Z	2UUC	0.71
PAR	PAROMOMYCIN	A,D,J,N,X	1XNQ	0.71
PAR	PAROMOMYCIN	A,D,E,J,M,N,Y	1N32	0.71
PAR	PAROMOMYCIN	A	2VQY	0.71
PAR	PAROMOMYCIN	A,B	3C44	0.71
PAR	PAROMOMYCIN	V,Z	2J00	0.71
PAR	PAROMOMYCIN	4,B	2Z4L	0.71
PAR	PAROMOMYCIN	V,Y,Z	2WDH	0.71
PAR	PAROMOMYCIN	A,D,J,N,Y	1IBL	0.71
PAR	PAROMOMYCIN	A,B,C,D	3BNR	0.71
PAR	PAROMOMYCIN	A,D,J,N,X	1XMO	0.71
PAR	PAROMOMYCIN	Y,Z	2VQF	0.71
PAR	PAROMOMYCIN	A,D,J,N,X	1XNR	0.71
AOG	4-AMINO-2-OCTYLOXY-6-HYDROXYMETHYL- TETRAHYDRO-PYRAN-3,5-DIOL	A	1R82	0.71
AM2	APRAMYCIN	B	2OE8	0.71
AM2	APRAMYCIN	A,B	2OE5	0.71
AM2	APRAMYCIN	A,B	1YRJ	0.71
AM2	APRAMYCIN	A,B	2G5K	0.71
MAG	BETA-METHYL-N-ACETYL-D-GLUCOSAMINE	A	1M7D	0.71
MAG	BETA-METHYL-N-ACETYL-D-GLUCOSAMINE	A	1LED	0.71
MAG	BETA-METHYL-N-ACETYL-D-GLUCOSAMINE	A	1GSL	0.71
MAG	BETA-METHYL-N-ACETYL-D-GLUCOSAMINE	A	1FWU	0.71
MAG	BETA-METHYL-N-ACETYL-D-GLUCOSAMINE	A,B,C,D	1G1R	0.71
MAG	BETA-METHYL-N-ACETYL-D-GLUCOSAMINE	A	1FWV	0.71
MAG	BETA-METHYL-N-ACETYL-D-GLUCOSAMINE	A	1G1T	0.71
MAG	BETA-METHYL-N-ACETYL-D-GLUCOSAMINE	1,2,3	3KMB	0.71
MAG	BETA-METHYL-N-ACETYL-D-GLUCOSAMINE	1,2,3	2KMB	0.71
MAG	BETA-METHYL-N-ACETYL-D-GLUCOSAMINE	A,B	1ZPL	0.71
MAG	BETA-METHYL-N-ACETYL-D-GLUCOSAMINE	1,2,3	4KMB	0.71
MAG	BETA-METHYL-N-ACETYL-D-GLUCOSAMINE	A,H	1UZ8	0.71
NMY	NEOMYCIN	A	2B0Q	0.71
NMY	NEOMYCIN	4,B	2QP1	0.71
NMY	NEOMYCIN	A,B	2ET4	0.71
NMY	NEOMYCIN	A,E,N	2QAN	0.71
NMY	NEOMYCIN	A,B	2FCY	0.71
NMY	NEOMYCIN	A	2QP0	0.71
NMY	NEOMYCIN	A	1I9V	0.71
NMY	NEOMYCIN	A	2QAL	0.71
NMY	NEOMYCIN	4,B	2QOZ	0.71
NMY	NEOMYCIN	A,C	2A04	0.71
NMY	NEOMYCIN	A	1EI2	0.71
NMY	NEOMYCIN	A,B	3C7R	0.71
NMY	NEOMYCIN	4,B	2QAM	0.71
NMY	NEOMYCIN	4,B	2QAO	0.71
NMY	NEOMYCIN	A	2QOY	0.71
MGC	ALPHA-METHYL-N-ACETYL-D-GALACTOSAMINE	A,C,E,G	1UH1	0.71
MGC	ALPHA-METHYL-N-ACETYL-D-GALACTOSAMINE	A,B,C,D	2DU1	0.71
MGC	ALPHA-METHYL-N-ACETYL-D-GALACTOSAMINE	A,C,E,G	1UH0	0.71
MGC	ALPHA-METHYL-N-ACETYL-D-GALACTOSAMINE	A,B,C,D	2DVA	0.71
MGC	ALPHA-METHYL-N-ACETYL-D-GALACTOSAMINE	A	1UGX	0.71
GAC	DIHYDRO-ACARBOSE	A	1GAI	0.71
ABD	ACARBOSE DERIVED HEXASACCHARIDE	A	1QHO	0.7
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	0.7
GET	GENETICIN	A	1MWL	0.7
GET	GENETICIN	A,B,C,D	1NJJ	0.7
RIO	RIBOSTAMYCIN	A,B	1M4G	0.7
RIO	RIBOSTAMYCIN	A,B	3C3Z	0.7
RIO	RIBOSTAMYCIN	A,B	1S3Z	0.7
RIO	RIBOSTAMYCIN	A,B,C,D	2FCZ	0.7
RIO	RIBOSTAMYCIN	A,B	2ET5	0.7
RIO	RIBOSTAMYCIN	A,B	3DVV	0.7
RIO	RIBOSTAMYCIN	A	2BUE	0.7
NND	(2R,3R,4R,5S)-2-(HYDROXYMETHYL)- 1-NONYLPIPERIDINE-3,4,5-TRIOL	A,B	2V3E	0.7
EAG	2-aminoethyl 2-(acetylamino)-2- deoxy-beta-D-glucopyranoside	B,D,E,F,H	3BZ4	0.7