MMsInc Molecule/ Ligand PDB

Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03694600

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
ABD	ACARBOSE DERIVED HEXASACCHARIDE	A	1QHO	0.72
17B	(2Z,3R,4S,5R,6R)-2-[(4-aminobutyl)imino]- 6-(hydroxymethyl)piperidine-3,4,5- triol	A,B	2VR4	0.75
5AX	2-(ACETYLAMINO)-1,5-ANHYDRO-2-DEOXY- D-GLUCITOL	A	2JCQ	0.78
5AX	2-(ACETYLAMINO)-1,5-ANHYDRO-2-DEOXY- D-GLUCITOL	A,B	2IH9	0.78
5AX	2-(ACETYLAMINO)-1,5-ANHYDRO-2-DEOXY- D-GLUCITOL	A,B,C,D,E,F	2J2P	0.78
5AX	2-(ACETYLAMINO)-1,5-ANHYDRO-2-DEOXY- D-GLUCITOL	A	3DIV	0.78
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
15A	(2Z,3R,4S,5R,6R)-2-[(2-aminoethyl)imino]- 6-(hydroxymethyl)piperidine-3,4,5- triol	A,B	2VQT	0.74
AD7	octyl 3-amino-3-deoxy-2-O-(2,6- dideoxy-alpha-L-lyxo-hexopyranosyl)- beta-D-galactopyranoside	A	2RJ9	0.71
AD7	octyl 3-amino-3-deoxy-2-O-(2,6- dideoxy-alpha-L-lyxo-hexopyranosyl)- beta-D-galactopyranoside	A	2RJ4	0.71
AS5	2-(acetylamino)-4-O-[2-(acetylamino)- 2-deoxy-alpha-L-gulopyranosyl]- 1,5-anhydro-2-deoxy-D-mannitol	A,B	2VLC	0.72
AMU	BETA-N-ACETYLMURAMIC ACID	A,B,C,D	2APH	0.7
AMU	BETA-N-ACETYLMURAMIC ACID	A,P	1TWQ	0.7
AMU	BETA-N-ACETYLMURAMIC ACID	A	1D0K	0.7
AMU	BETA-N-ACETYLMURAMIC ACID	S	9LYZ	0.7
AMU	BETA-N-ACETYLMURAMIC ACID	E,S	148L	0.7
AMU	BETA-N-ACETYLMURAMIC ACID	D,K	3CYQ	0.7
AMU	BETA-N-ACETYLMURAMIC ACID	U	2AIZ	0.7
A2G	N-ACETYL-2-DEOXY-2-AMINO-GALACTOSE	A,B,C,D	2E51	0.75
A2G	N-ACETYL-2-DEOXY-2-AMINO-GALACTOSE	A	1D0H	0.75
A2G	N-ACETYL-2-DEOXY-2-AMINO-GALACTOSE	A	1JOT	0.75
A2G	N-ACETYL-2-DEOXY-2-AMINO-GALACTOSE	A	1LLP	0.75
A2G	N-ACETYL-2-DEOXY-2-AMINO-GALACTOSE	X,Y	2EAL	0.75
A2G	N-ACETYL-2-DEOXY-2-AMINO-GALACTOSE	A,B	1LU2	0.75
A2G	N-ACETYL-2-DEOXY-2-AMINO-GALACTOSE	A,B,C,E,F	2J3F	0.75
A2G	N-ACETYL-2-DEOXY-2-AMINO-GALACTOSE	A	1LU1	0.75
A2G	N-ACETYL-2-DEOXY-2-AMINO-GALACTOSE	D,E,F,G,H,I, J,K,L,M	3EFX	0.75
A2G	N-ACETYL-2-DEOXY-2-AMINO-GALACTOSE	A	2VMC	0.75
A2G	N-ACETYL-2-DEOXY-2-AMINO-GALACTOSE	A,B	2W7Y	0.75
A2G	N-ACETYL-2-DEOXY-2-AMINO-GALACTOSE	A	1FNZ	0.75
A2G	N-ACETYL-2-DEOXY-2-AMINO-GALACTOSE	A,B,C,D	2W1U	0.75
A2G	N-ACETYL-2-DEOXY-2-AMINO-GALACTOSE	F	2JHI	0.75
A2G	N-ACETYL-2-DEOXY-2-AMINO-GALACTOSE	A,C,E,G	1M26	0.75
A2G	N-ACETYL-2-DEOXY-2-AMINO-GALACTOSE	A,B,C,D	2DTY	0.75
A2G	N-ACETYL-2-DEOXY-2-AMINO-GALACTOSE	A,B	2J1U	0.75
A2G	N-ACETYL-2-DEOXY-2-AMINO-GALACTOSE	A	2CCV	0.75
A2G	N-ACETYL-2-DEOXY-2-AMINO-GALACTOSE	A	2A2D	0.75
A2G	N-ACETYL-2-DEOXY-2-AMINO-GALACTOSE	A	2AYS	0.75
A2G	N-ACETYL-2-DEOXY-2-AMINO-GALACTOSE	A,B,C,D	2ZUT	0.75
A2G	N-ACETYL-2-DEOXY-2-AMINO-GALACTOSE	A	1KYJ	0.75
A2G	N-ACETYL-2-DEOXY-2-AMINO-GALACTOSE	A,B	2VNG	0.75
A2G	N-ACETYL-2-DEOXY-2-AMINO-GALACTOSE	A,B	2Z48	0.75
A2G	N-ACETYL-2-DEOXY-2-AMINO-GALACTOSE	1,2,3	1BCH	0.75
A2G	N-ACETYL-2-DEOXY-2-AMINO-GALACTOSE	A	2K33	0.75
A2G	N-ACETYL-2-DEOXY-2-AMINO-GALACTOSE	A	2IXB	0.75
A2G	N-ACETYL-2-DEOXY-2-AMINO-GALACTOSE	A,B	1ULF	0.75
A2G	N-ACETYL-2-DEOXY-2-AMINO-GALACTOSE	A,B	1JLX	0.75
A2G	N-ACETYL-2-DEOXY-2-AMINO-GALACTOSE	A	1AX0	0.75
A2G	N-ACETYL-2-DEOXY-2-AMINO-GALACTOSE	A	3CA3	0.75
A2G	N-ACETYL-2-DEOXY-2-AMINO-GALACTOSE	A,B,C,D	1WMZ	0.75
A2G	N-ACETYL-2-DEOXY-2-AMINO-GALACTOSE	A	3CA6	0.75
A2G	N-ACETYL-2-DEOXY-2-AMINO-GALACTOSE	D,E,G,H	1LTI	0.75
A2G	N-ACETYL-2-DEOXY-2-AMINO-GALACTOSE	A,B,C,D	2E7T	0.75
A2G	N-ACETYL-2-DEOXY-2-AMINO-GALACTOSE	N,O,P,Q,R,S, T,U,V,W	2O2L	0.75
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
AGH	N-{(1S,2R,3S)-1-[(ALPHA-D-GALACTOPYRANOSYLOXY)METHYL]- 2,3-DIHYDROXYHEPTADECYL}HEXACOSANAMIDE	A	1ZT4	0.7
AGH	N-{(1S,2R,3S)-1-[(ALPHA-D-GALACTOPYRANOSYLOXY)METHYL]- 2,3-DIHYDROXYHEPTADECYL}HEXACOSANAMIDE	A,C,E	2PO6	0.7
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	0.71
233	[5-(3,4,5-TRIHYDROXY-6-HYDROXYMETHYL- TETRAHYDRO-PYRAN-2-YLCARBAMOYL)- PENTYL]-CARBAMIC ACID METHYL ESTER	D,E,F,G,H	1MD2	0.71
ASG	2-DEOXY-2-ACETAMIDO-BETA-D-GALACTOSE- 4-SULFATE	A	1RWG	0.71
ASG	2-DEOXY-2-ACETAMIDO-BETA-D-GALACTOSE- 4-SULFATE	A	1HM2	0.71
ASG	2-DEOXY-2-ACETAMIDO-BETA-D-GALACTOSE- 4-SULFATE	A	1RWF	0.71
ASG	2-DEOXY-2-ACETAMIDO-BETA-D-GALACTOSE- 4-SULFATE	A	1OFL	0.71
ASG	2-DEOXY-2-ACETAMIDO-BETA-D-GALACTOSE- 4-SULFATE	A	3C9E	0.71
ASG	2-DEOXY-2-ACETAMIDO-BETA-D-GALACTOSE- 4-SULFATE	A	2C4S	0.71
ASG	2-DEOXY-2-ACETAMIDO-BETA-D-GALACTOSE- 4-SULFATE	A	1C4S	0.71
ASG	2-DEOXY-2-ACETAMIDO-BETA-D-GALACTOSE- 4-SULFATE	A	1OFM	0.71
ASG	2-DEOXY-2-ACETAMIDO-BETA-D-GALACTOSE- 4-SULFATE	A	1OJO	0.71
ASG	2-DEOXY-2-ACETAMIDO-BETA-D-GALACTOSE- 4-SULFATE	A	1HMW	0.71
ASG	2-DEOXY-2-ACETAMIDO-BETA-D-GALACTOSE- 4-SULFATE	A	1DQO	0.71
ASG	2-DEOXY-2-ACETAMIDO-BETA-D-GALACTOSE- 4-SULFATE	A	1HMU	0.71
ASG	2-DEOXY-2-ACETAMIDO-BETA-D-GALACTOSE- 4-SULFATE	A	1RWH	0.71
8GP		A	2F3U	0.73
1GN	2-DEOXY-2-AMINOGALACTOSE	A,B	3GAL	0.72
AGL	4,6-DIDEOXY-4-AMINO-ALPHA-D-GLUCOSE	A	1CPU	0.74
AGL	4,6-DIDEOXY-4-AMINO-ALPHA-D-GLUCOSE	A	1NM9	0.74
AGL	4,6-DIDEOXY-4-AMINO-ALPHA-D-GLUCOSE	A	1MFV	0.74
AGL	4,6-DIDEOXY-4-AMINO-ALPHA-D-GLUCOSE	A	1PIG	0.74
AGL	4,6-DIDEOXY-4-AMINO-ALPHA-D-GLUCOSE	X	1Z32	0.74
AGL	4,6-DIDEOXY-4-AMINO-ALPHA-D-GLUCOSE	A	1MFU	0.74
AGL	4,6-DIDEOXY-4-AMINO-ALPHA-D-GLUCOSE	A	3BLK	0.74
AGL	4,6-DIDEOXY-4-AMINO-ALPHA-D-GLUCOSE	X	3BLP	0.74
AGL	4,6-DIDEOXY-4-AMINO-ALPHA-D-GLUCOSE	A	3DHP	0.74
AOG	4-AMINO-2-OCTYLOXY-6-HYDROXYMETHYL- TETRAHYDRO-PYRAN-3,5-DIOL	A	1R82	0.72
AIG	4-AMINO-2-HEXYLOXY-6-HYDROXYMETHYL- TETRAHYDRO-PYRAN-3,5-DIOL	A	1R7Y	0.75
AIG	4-AMINO-2-HEXYLOXY-6-HYDROXYMETHYL- TETRAHYDRO-PYRAN-3,5-DIOL	A	1R7X	0.75
AIG	4-AMINO-2-HEXYLOXY-6-HYDROXYMETHYL- TETRAHYDRO-PYRAN-3,5-DIOL	A	1R81	0.75
AIG	4-AMINO-2-HEXYLOXY-6-HYDROXYMETHYL- TETRAHYDRO-PYRAN-3,5-DIOL	A	1R7V	0.75
AIG	4-AMINO-2-HEXYLOXY-6-HYDROXYMETHYL- TETRAHYDRO-PYRAN-3,5-DIOL	A	1R80	0.75
16G	N-ACETYL-D-GLUCOSAMINE-6-PHOSPHATE	A,B,D	1I1D	0.7
16G	N-ACETYL-D-GLUCOSAMINE-6-PHOSPHATE	A,B	2DKC	0.7
16G	N-ACETYL-D-GLUCOSAMINE-6-PHOSPHATE	A,B,C,D,E,F	1NE7	0.7
16G	N-ACETYL-D-GLUCOSAMINE-6-PHOSPHATE	A,B	1FS5	0.7
16G	N-ACETYL-D-GLUCOSAMINE-6-PHOSPHATE	A,B	2O28	0.7
16G	N-ACETYL-D-GLUCOSAMINE-6-PHOSPHATE	A,B	1FRZ	0.7
16G	N-ACETYL-D-GLUCOSAMINE-6-PHOSPHATE	A,B	1HOT	0.7
16G	N-ACETYL-D-GLUCOSAMINE-6-PHOSPHATE	A	2VXK	0.7