MMsInc Molecule/ Ligand PDB

Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00754724

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
AMU	BETA-N-ACETYLMURAMIC ACID	A,B,C,D	2APH	0.73
AMU	BETA-N-ACETYLMURAMIC ACID	A,P	1TWQ	0.73
AMU	BETA-N-ACETYLMURAMIC ACID	A	1D0K	0.73
AMU	BETA-N-ACETYLMURAMIC ACID	S	9LYZ	0.73
AMU	BETA-N-ACETYLMURAMIC ACID	E,S	148L	0.73
AMU	BETA-N-ACETYLMURAMIC ACID	D,K	3CYQ	0.73
AMU	BETA-N-ACETYLMURAMIC ACID	U	2AIZ	0.73
2TB	1,3-DIAMINO-4,5,6-TRIHYDROXY-CYCLOHEXANE	A	2TOB	0.75
AS5	2-(acetylamino)-4-O-[2-(acetylamino)- 2-deoxy-alpha-L-gulopyranosyl]- 1,5-anhydro-2-deoxy-D-mannitol	A,B	2VLC	0.73
AGL	4,6-DIDEOXY-4-AMINO-ALPHA-D-GLUCOSE	A	1CPU	0.94
AGL	4,6-DIDEOXY-4-AMINO-ALPHA-D-GLUCOSE	A	1NM9	0.94
AGL	4,6-DIDEOXY-4-AMINO-ALPHA-D-GLUCOSE	A	1MFV	0.94
AGL	4,6-DIDEOXY-4-AMINO-ALPHA-D-GLUCOSE	A	1PIG	0.94
AGL	4,6-DIDEOXY-4-AMINO-ALPHA-D-GLUCOSE	X	1Z32	0.94
AGL	4,6-DIDEOXY-4-AMINO-ALPHA-D-GLUCOSE	A	1MFU	0.94
AGL	4,6-DIDEOXY-4-AMINO-ALPHA-D-GLUCOSE	A	3BLK	0.94
AGL	4,6-DIDEOXY-4-AMINO-ALPHA-D-GLUCOSE	X	3BLP	0.94
AGL	4,6-DIDEOXY-4-AMINO-ALPHA-D-GLUCOSE	A	3DHP	0.94
AOG	4-AMINO-2-OCTYLOXY-6-HYDROXYMETHYL- TETRAHYDRO-PYRAN-3,5-DIOL	A	1R82	0.83
AGP	2-DEOXY-2-AMINO GLUCITOL-6-PHOSPHATE	A,B,C,D,E,F	1NE7	0.72
AGP	2-DEOXY-2-AMINO GLUCITOL-6-PHOSPHATE	A	2ZJ4	0.72
AGP	2-DEOXY-2-AMINO GLUCITOL-6-PHOSPHATE	A	1MOS	0.72
AGP	2-DEOXY-2-AMINO GLUCITOL-6-PHOSPHATE	A,B	1HOR	0.72
BDG	O-2,6-DIAMINO-2,6-DIDEOXY-ALPHA- D-GLUCOPYRANOSE	A	1QD3	0.95
BDG	O-2,6-DIAMINO-2,6-DIDEOXY-ALPHA- D-GLUCOPYRANOSE	B	1O9M	0.95
BDG	O-2,6-DIAMINO-2,6-DIDEOXY-ALPHA- D-GLUCOPYRANOSE	A	1NEM	0.95
ASG	2-DEOXY-2-ACETAMIDO-BETA-D-GALACTOSE- 4-SULFATE	A	1RWG	0.75
ASG	2-DEOXY-2-ACETAMIDO-BETA-D-GALACTOSE- 4-SULFATE	A	1HM2	0.75
ASG	2-DEOXY-2-ACETAMIDO-BETA-D-GALACTOSE- 4-SULFATE	A	1RWF	0.75
ASG	2-DEOXY-2-ACETAMIDO-BETA-D-GALACTOSE- 4-SULFATE	A	1OFL	0.75
ASG	2-DEOXY-2-ACETAMIDO-BETA-D-GALACTOSE- 4-SULFATE	A	3C9E	0.75
ASG	2-DEOXY-2-ACETAMIDO-BETA-D-GALACTOSE- 4-SULFATE	A	2C4S	0.75
ASG	2-DEOXY-2-ACETAMIDO-BETA-D-GALACTOSE- 4-SULFATE	A	1C4S	0.75
ASG	2-DEOXY-2-ACETAMIDO-BETA-D-GALACTOSE- 4-SULFATE	A	1OFM	0.75
ASG	2-DEOXY-2-ACETAMIDO-BETA-D-GALACTOSE- 4-SULFATE	A	1OJO	0.75
ASG	2-DEOXY-2-ACETAMIDO-BETA-D-GALACTOSE- 4-SULFATE	A	1HMW	0.75
ASG	2-DEOXY-2-ACETAMIDO-BETA-D-GALACTOSE- 4-SULFATE	A	1DQO	0.75
ASG	2-DEOXY-2-ACETAMIDO-BETA-D-GALACTOSE- 4-SULFATE	A	1HMU	0.75
ASG	2-DEOXY-2-ACETAMIDO-BETA-D-GALACTOSE- 4-SULFATE	A	1RWH	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	0.81
AOL	(1R,2R,3S,4S,5R)-5-AMINOCYCLOPENTANE- 1,2,3,4-TETROL	A	2F7Q	0.73
5AX	2-(ACETYLAMINO)-1,5-ANHYDRO-2-DEOXY- D-GLUCITOL	A	2JCQ	0.71
5AX	2-(ACETYLAMINO)-1,5-ANHYDRO-2-DEOXY- D-GLUCITOL	A,B	2IH9	0.71
5AX	2-(ACETYLAMINO)-1,5-ANHYDRO-2-DEOXY- D-GLUCITOL	A,B,C,D,E,F	2J2P	0.71
5AX	2-(ACETYLAMINO)-1,5-ANHYDRO-2-DEOXY- D-GLUCITOL	A	3DIV	0.71
ABL	6-HYDROXYMETHYL-5-(3,4,5-TRIHYDROXY- 6-HYDROXYMETHYL-TETRAHYDRO-PYRAN- 2-YLOXY)-PIPERIDINE-2,3,4-TRIOL	A,B	1NAA	0.8
ABL	6-HYDROXYMETHYL-5-(3,4,5-TRIHYDROXY- 6-HYDROXYMETHYL-TETRAHYDRO-PYRAN- 2-YLOXY)-PIPERIDINE-2,3,4-TRIOL	A	2AXR	0.8
AD7	octyl 3-amino-3-deoxy-2-O-(2,6- dideoxy-alpha-L-lyxo-hexopyranosyl)- beta-D-galactopyranoside	A	2RJ9	0.78
AD7	octyl 3-amino-3-deoxy-2-O-(2,6- dideoxy-alpha-L-lyxo-hexopyranosyl)- beta-D-galactopyranoside	A	2RJ4	0.78
AIG	4-AMINO-2-HEXYLOXY-6-HYDROXYMETHYL- TETRAHYDRO-PYRAN-3,5-DIOL	A	1R7Y	0.86
AIG	4-AMINO-2-HEXYLOXY-6-HYDROXYMETHYL- TETRAHYDRO-PYRAN-3,5-DIOL	A	1R7X	0.86
AIG	4-AMINO-2-HEXYLOXY-6-HYDROXYMETHYL- TETRAHYDRO-PYRAN-3,5-DIOL	A	1R81	0.86
AIG	4-AMINO-2-HEXYLOXY-6-HYDROXYMETHYL- TETRAHYDRO-PYRAN-3,5-DIOL	A	1R7V	0.86
AIG	4-AMINO-2-HEXYLOXY-6-HYDROXYMETHYL- TETRAHYDRO-PYRAN-3,5-DIOL	A	1R80	0.86
16G	N-ACETYL-D-GLUCOSAMINE-6-PHOSPHATE	A,B,D	1I1D	0.73
16G	N-ACETYL-D-GLUCOSAMINE-6-PHOSPHATE	A,B	2DKC	0.73
16G	N-ACETYL-D-GLUCOSAMINE-6-PHOSPHATE	A,B,C,D,E,F	1NE7	0.73
16G	N-ACETYL-D-GLUCOSAMINE-6-PHOSPHATE	A,B	1FS5	0.73
16G	N-ACETYL-D-GLUCOSAMINE-6-PHOSPHATE	A,B	2O28	0.73
16G	N-ACETYL-D-GLUCOSAMINE-6-PHOSPHATE	A,B	1FRZ	0.73
16G	N-ACETYL-D-GLUCOSAMINE-6-PHOSPHATE	A,B	1HOT	0.73
16G	N-ACETYL-D-GLUCOSAMINE-6-PHOSPHATE	A	2VXK	0.73
A2G	N-ACETYL-2-DEOXY-2-AMINO-GALACTOSE	A,B,C,D	2E51	0.8
A2G	N-ACETYL-2-DEOXY-2-AMINO-GALACTOSE	A	1D0H	0.8
A2G	N-ACETYL-2-DEOXY-2-AMINO-GALACTOSE	A	1JOT	0.8
A2G	N-ACETYL-2-DEOXY-2-AMINO-GALACTOSE	A	1LLP	0.8
A2G	N-ACETYL-2-DEOXY-2-AMINO-GALACTOSE	X,Y	2EAL	0.8
A2G	N-ACETYL-2-DEOXY-2-AMINO-GALACTOSE	A,B	1LU2	0.8
A2G	N-ACETYL-2-DEOXY-2-AMINO-GALACTOSE	A,B,C,E,F	2J3F	0.8
A2G	N-ACETYL-2-DEOXY-2-AMINO-GALACTOSE	A	1LU1	0.8
A2G	N-ACETYL-2-DEOXY-2-AMINO-GALACTOSE	D,E,F,G,H,I, J,K,L,M	3EFX	0.8
A2G	N-ACETYL-2-DEOXY-2-AMINO-GALACTOSE	A	2VMC	0.8
A2G	N-ACETYL-2-DEOXY-2-AMINO-GALACTOSE	A,B	2W7Y	0.8
A2G	N-ACETYL-2-DEOXY-2-AMINO-GALACTOSE	A	1FNZ	0.8
A2G	N-ACETYL-2-DEOXY-2-AMINO-GALACTOSE	A,B,C,D	2W1U	0.8
A2G	N-ACETYL-2-DEOXY-2-AMINO-GALACTOSE	F	2JHI	0.8
A2G	N-ACETYL-2-DEOXY-2-AMINO-GALACTOSE	A,C,E,G	1M26	0.8
A2G	N-ACETYL-2-DEOXY-2-AMINO-GALACTOSE	A,B,C,D	2DTY	0.8
A2G	N-ACETYL-2-DEOXY-2-AMINO-GALACTOSE	A,B	2J1U	0.8
A2G	N-ACETYL-2-DEOXY-2-AMINO-GALACTOSE	A	2CCV	0.8
A2G	N-ACETYL-2-DEOXY-2-AMINO-GALACTOSE	A	2A2D	0.8
A2G	N-ACETYL-2-DEOXY-2-AMINO-GALACTOSE	A	2AYS	0.8
A2G	N-ACETYL-2-DEOXY-2-AMINO-GALACTOSE	A,B,C,D	2ZUT	0.8
A2G	N-ACETYL-2-DEOXY-2-AMINO-GALACTOSE	A	1KYJ	0.8
A2G	N-ACETYL-2-DEOXY-2-AMINO-GALACTOSE	A,B	2VNG	0.8
A2G	N-ACETYL-2-DEOXY-2-AMINO-GALACTOSE	A,B	2Z48	0.8
A2G	N-ACETYL-2-DEOXY-2-AMINO-GALACTOSE	1,2,3	1BCH	0.8
A2G	N-ACETYL-2-DEOXY-2-AMINO-GALACTOSE	A	2K33	0.8
A2G	N-ACETYL-2-DEOXY-2-AMINO-GALACTOSE	A	2IXB	0.8
A2G	N-ACETYL-2-DEOXY-2-AMINO-GALACTOSE	A,B	1ULF	0.8
A2G	N-ACETYL-2-DEOXY-2-AMINO-GALACTOSE	A,B	1JLX	0.8
A2G	N-ACETYL-2-DEOXY-2-AMINO-GALACTOSE	A	1AX0	0.8
A2G	N-ACETYL-2-DEOXY-2-AMINO-GALACTOSE	A	3CA3	0.8
A2G	N-ACETYL-2-DEOXY-2-AMINO-GALACTOSE	A,B,C,D	1WMZ	0.8
A2G	N-ACETYL-2-DEOXY-2-AMINO-GALACTOSE	A	3CA6	0.8
A2G	N-ACETYL-2-DEOXY-2-AMINO-GALACTOSE	D,E,G,H	1LTI	0.8
A2G	N-ACETYL-2-DEOXY-2-AMINO-GALACTOSE	A,B,C,D	2E7T	0.8
A2G	N-ACETYL-2-DEOXY-2-AMINO-GALACTOSE	N,O,P,Q,R,S, T,U,V,W	2O2L	0.8
BGN	N-BUTANOYL-2-AMINO-2-DEOXY-GLUCOPYRANOSIDE	A,B,C,D	1NWG	0.77
1GN	2-DEOXY-2-AMINOGALACTOSE	A,B	3GAL	1
9MR	(3R,4R,5R)-3-HYDROXY-5-(HYDROXYMETHYL)PIPERIDIN- 4-YL BETA-D-GLUCOPYRANOSIDE	A	3CUF	0.71
9MR	(3R,4R,5R)-3-HYDROXY-5-(HYDROXYMETHYL)PIPERIDIN- 4-YL BETA-D-GLUCOPYRANOSIDE	A,B	2OYK	0.71
AMV	METHYL 2-(ACETYLAMINO)-3-O-[(1R)- 1-CARBOXYETHYL]-2-DEOXY-BETA-D- GLUCOPYRANOSIDE	A	2J8G	0.71
AMV	METHYL 2-(ACETYLAMINO)-3-O-[(1R)- 1-CARBOXYETHYL]-2-DEOXY-BETA-D- GLUCOPYRANOSIDE	A	2J8F	0.71