MMsInc Molecule/ Ligand PDB

Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02417245

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
ABL	6-HYDROXYMETHYL-5-(3,4,5-TRIHYDROXY- 6-HYDROXYMETHYL-TETRAHYDRO-PYRAN- 2-YLOXY)-PIPERIDINE-2,3,4-TRIOL	A,B	1NAA	0.74
ABL	6-HYDROXYMETHYL-5-(3,4,5-TRIHYDROXY- 6-HYDROXYMETHYL-TETRAHYDRO-PYRAN- 2-YLOXY)-PIPERIDINE-2,3,4-TRIOL	A	2AXR	0.74
AR4	2-AMINO-5-(3-FLUORO-3,4-DIHYDROXY- 5-HYDROXYMETHYL-TETRAHYDRO-FURAN- 2-YLOXY)-5-HYDROXY-PENTANOIC ACID	A,B,C	1S2D	0.72
A2G	N-ACETYL-2-DEOXY-2-AMINO-GALACTOSE	A,B,C,D	2E51	0.72
A2G	N-ACETYL-2-DEOXY-2-AMINO-GALACTOSE	A	1D0H	0.72
A2G	N-ACETYL-2-DEOXY-2-AMINO-GALACTOSE	A	1JOT	0.72
A2G	N-ACETYL-2-DEOXY-2-AMINO-GALACTOSE	A	1LLP	0.72
A2G	N-ACETYL-2-DEOXY-2-AMINO-GALACTOSE	X,Y	2EAL	0.72
A2G	N-ACETYL-2-DEOXY-2-AMINO-GALACTOSE	A,B	1LU2	0.72
A2G	N-ACETYL-2-DEOXY-2-AMINO-GALACTOSE	A,B,C,E,F	2J3F	0.72
A2G	N-ACETYL-2-DEOXY-2-AMINO-GALACTOSE	A	1LU1	0.72
A2G	N-ACETYL-2-DEOXY-2-AMINO-GALACTOSE	D,E,F,G,H,I, J,K,L,M	3EFX	0.72
A2G	N-ACETYL-2-DEOXY-2-AMINO-GALACTOSE	A	2VMC	0.72
A2G	N-ACETYL-2-DEOXY-2-AMINO-GALACTOSE	A,B	2W7Y	0.72
A2G	N-ACETYL-2-DEOXY-2-AMINO-GALACTOSE	A	1FNZ	0.72
A2G	N-ACETYL-2-DEOXY-2-AMINO-GALACTOSE	A,B,C,D	2W1U	0.72
A2G	N-ACETYL-2-DEOXY-2-AMINO-GALACTOSE	F	2JHI	0.72
A2G	N-ACETYL-2-DEOXY-2-AMINO-GALACTOSE	A,C,E,G	1M26	0.72
A2G	N-ACETYL-2-DEOXY-2-AMINO-GALACTOSE	A,B,C,D	2DTY	0.72
A2G	N-ACETYL-2-DEOXY-2-AMINO-GALACTOSE	A,B	2J1U	0.72
A2G	N-ACETYL-2-DEOXY-2-AMINO-GALACTOSE	A	2CCV	0.72
A2G	N-ACETYL-2-DEOXY-2-AMINO-GALACTOSE	A	2A2D	0.72
A2G	N-ACETYL-2-DEOXY-2-AMINO-GALACTOSE	A	2AYS	0.72
A2G	N-ACETYL-2-DEOXY-2-AMINO-GALACTOSE	A,B,C,D	2ZUT	0.72
A2G	N-ACETYL-2-DEOXY-2-AMINO-GALACTOSE	A	1KYJ	0.72
A2G	N-ACETYL-2-DEOXY-2-AMINO-GALACTOSE	A,B	2VNG	0.72
A2G	N-ACETYL-2-DEOXY-2-AMINO-GALACTOSE	A,B	2Z48	0.72
A2G	N-ACETYL-2-DEOXY-2-AMINO-GALACTOSE	1,2,3	1BCH	0.72
A2G	N-ACETYL-2-DEOXY-2-AMINO-GALACTOSE	A	2K33	0.72
A2G	N-ACETYL-2-DEOXY-2-AMINO-GALACTOSE	A	2IXB	0.72
A2G	N-ACETYL-2-DEOXY-2-AMINO-GALACTOSE	A,B	1ULF	0.72
A2G	N-ACETYL-2-DEOXY-2-AMINO-GALACTOSE	A,B	1JLX	0.72
A2G	N-ACETYL-2-DEOXY-2-AMINO-GALACTOSE	A	1AX0	0.72
A2G	N-ACETYL-2-DEOXY-2-AMINO-GALACTOSE	A	3CA3	0.72
A2G	N-ACETYL-2-DEOXY-2-AMINO-GALACTOSE	A,B,C,D	1WMZ	0.72
A2G	N-ACETYL-2-DEOXY-2-AMINO-GALACTOSE	A	3CA6	0.72
A2G	N-ACETYL-2-DEOXY-2-AMINO-GALACTOSE	D,E,G,H	1LTI	0.72
A2G	N-ACETYL-2-DEOXY-2-AMINO-GALACTOSE	A,B,C,D	2E7T	0.72
A2G	N-ACETYL-2-DEOXY-2-AMINO-GALACTOSE	N,O,P,Q,R,S, T,U,V,W	2O2L	0.72
GCS	D-GLUCOSAMINE	A	3CO4	0.86
GCS	D-GLUCOSAMINE	A	1QGI	0.86
GCS	D-GLUCOSAMINE	A,B	2VZS	0.86
GCS	D-GLUCOSAMINE	A	1E9L	0.86
GCS	D-GLUCOSAMINE	A,B,C,D	3FXI	0.86
GCS	D-GLUCOSAMINE	A,B	2VZV	0.86
GDA	4-DEOXY-4-AMINO-BETA-D-GLUCOSE	A,B	1OCB	0.9
DR3	6-DEOXY-ALPHA-L-GLUCOPYRANOSYL- (1->2)-BETA-D-GULOPYRANOSYL-(1- >3)-2-DEOXY-2-[(1-HYDROXYETHYL)AMINO]- ALPHA-L-TALOPYRANOSE	A	1ZJ2	0.72
DR3	6-DEOXY-ALPHA-L-GLUCOPYRANOSYL- (1->2)-BETA-D-GULOPYRANOSYL-(1- >3)-2-DEOXY-2-[(1-HYDROXYETHYL)AMINO]- ALPHA-L-TALOPYRANOSE	A	1ZI5	0.72
AD7	octyl 3-amino-3-deoxy-2-O-(2,6- dideoxy-alpha-L-lyxo-hexopyranosyl)- beta-D-galactopyranoside	A	2RJ9	0.82
AD7	octyl 3-amino-3-deoxy-2-O-(2,6- dideoxy-alpha-L-lyxo-hexopyranosyl)- beta-D-galactopyranoside	A	2RJ4	0.82
ARW	METHYL BETA-D-ARABINOPYRANOSIDE	A,B,C,D	2BOJ	0.72
AIG	4-AMINO-2-HEXYLOXY-6-HYDROXYMETHYL- TETRAHYDRO-PYRAN-3,5-DIOL	A	1R7Y	0.9
AIG	4-AMINO-2-HEXYLOXY-6-HYDROXYMETHYL- TETRAHYDRO-PYRAN-3,5-DIOL	A	1R7X	0.9
AIG	4-AMINO-2-HEXYLOXY-6-HYDROXYMETHYL- TETRAHYDRO-PYRAN-3,5-DIOL	A	1R81	0.9
AIG	4-AMINO-2-HEXYLOXY-6-HYDROXYMETHYL- TETRAHYDRO-PYRAN-3,5-DIOL	A	1R7V	0.9
AIG	4-AMINO-2-HEXYLOXY-6-HYDROXYMETHYL- TETRAHYDRO-PYRAN-3,5-DIOL	A	1R80	0.9
GCN	3-DEOXY-D-GLUCOSAMINE	A	1FI1	0.86
GCN	3-DEOXY-D-GLUCOSAMINE	A	1QFG	0.86
GCN	3-DEOXY-D-GLUCOSAMINE	A	1QKC	0.86
GCN	3-DEOXY-D-GLUCOSAMINE	A,B	2GRX	0.86
GCN	3-DEOXY-D-GLUCOSAMINE	A	1QJQ	0.86
GCN	3-DEOXY-D-GLUCOSAMINE	A	1QFF	0.86
AOL	(1R,2R,3S,4S,5R)-5-AMINOCYCLOPENTANE- 1,2,3,4-TETROL	A	2F7Q	0.71
BM3	2-(ACETYLAMINO)-2-DEOXY-ALPHA-D- MANNOPYRANOSE	A,B,C,D,E,F	2J0G	0.72
BM3	2-(ACETYLAMINO)-2-DEOXY-ALPHA-D- MANNOPYRANOSE	A,B,C	2ORJ	0.72
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	0.75
EMP	2,4-DIDEOXY-4-(ETHYLAMINO)-3-O- METHYL ALPHA-L-THREO-PENTOPYRANOSIDE	A	2PIK	0.76
BDG	O-2,6-DIAMINO-2,6-DIDEOXY-ALPHA- D-GLUCOPYRANOSE	A	1QD3	0.87
BDG	O-2,6-DIAMINO-2,6-DIDEOXY-ALPHA- D-GLUCOPYRANOSE	B	1O9M	0.87
BDG	O-2,6-DIAMINO-2,6-DIDEOXY-ALPHA- D-GLUCOPYRANOSE	A	1NEM	0.87
AOG	4-AMINO-2-OCTYLOXY-6-HYDROXYMETHYL- TETRAHYDRO-PYRAN-3,5-DIOL	A	1R82	0.86
DAG	4,6-DIDEOXY-4-AMINO-BETA-D-GLUCOPYRANOSIDE	A	2PIK	0.92
DAG	4,6-DIDEOXY-4-AMINO-BETA-D-GLUCOPYRANOSIDE	A	6CGT	0.92
DAG	4,6-DIDEOXY-4-AMINO-BETA-D-GLUCOPYRANOSIDE	A,B	1PIK	0.92
1GN	2-DEOXY-2-AMINOGALACTOSE	A,B	3GAL	0.86
AGL	4,6-DIDEOXY-4-AMINO-ALPHA-D-GLUCOSE	A	1CPU	0.92
AGL	4,6-DIDEOXY-4-AMINO-ALPHA-D-GLUCOSE	A	1NM9	0.92
AGL	4,6-DIDEOXY-4-AMINO-ALPHA-D-GLUCOSE	A	1MFV	0.92
AGL	4,6-DIDEOXY-4-AMINO-ALPHA-D-GLUCOSE	A	1PIG	0.92
AGL	4,6-DIDEOXY-4-AMINO-ALPHA-D-GLUCOSE	X	1Z32	0.92
AGL	4,6-DIDEOXY-4-AMINO-ALPHA-D-GLUCOSE	A	1MFU	0.92
AGL	4,6-DIDEOXY-4-AMINO-ALPHA-D-GLUCOSE	A	3BLK	0.92
AGL	4,6-DIDEOXY-4-AMINO-ALPHA-D-GLUCOSE	X	3BLP	0.92
AGL	4,6-DIDEOXY-4-AMINO-ALPHA-D-GLUCOSE	A	3DHP	0.92
EAG	2-aminoethyl 2-(acetylamino)-2- deoxy-beta-D-glucopyranoside	B,D,E,F,H	3BZ4	0.73