MMsInc Molecule/ Ligand PDB

Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02853660

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
B3H	(2S)-2-(BUTYRYLOXY)-3-HYDROXYPROPYL NONANOATE	C,D	2HFE	0.75
B3H	(2S)-2-(BUTYRYLOXY)-3-HYDROXYPROPYL NONANOATE	C,D	2H8P	0.75
B3H	(2S)-2-(BUTYRYLOXY)-3-HYDROXYPROPYL NONANOATE	C,D	2HG5	0.75
PD7	(2R)-3-(phosphonooxy)propane-1,2- diyl diheptanoate	A	2ZE9	0.7
CNS	HEXADECYL OCTANOATE	A,B	1U9O	0.72
CNS	HEXADECYL OCTANOATE	A	1U9N	0.72
TGL	TRISTEAROYLGLYCEROL	A,B,C,D,F,G, I,J,L,M,N,O, P,Q,S,T,V,W,Z	2DYR	0.79
TGL	TRISTEAROYLGLYCEROL	A,B,C,D,F,G, I,J,L,M,N,O, P,S,T,V,W,Z	2EIM	0.79
TGL	TRISTEAROYLGLYCEROL	A,B,C,D,F,G, I,J,L,M,N,O, P,Q,S,T,V,W,Z	2EIL	0.79
TGL	TRISTEAROYLGLYCEROL	A,B,C,D,F,G, I,J,L,M,N,O, P,S,T,V,W,Z	2DYS	0.79
TGL	TRISTEAROYLGLYCEROL	A,B,C,F,G,I, J,L,M,N,O,P, S,T,V,W,Z	2EIJ	0.79
TGL	TRISTEAROYLGLYCEROL	A,B,C,D,E,F, G,I,J,L,M,N, O,P,Q,S,T,V, W,Z	1V54	0.79
TGL	TRISTEAROYLGLYCEROL	A,B,C,D,F,G, J,L,M,N,O,P, S,T,W,Z	2ZXW	0.79
TGL	TRISTEAROYLGLYCEROL	A,B,C,E,F,G, I,J,L,M,N,O, P,Q,S,T,V,W, Y,Z	2EIK	0.79
TGL	TRISTEAROYLGLYCEROL	A,B,C,E,F,G, I,J,M,N,O,P, Q,S,T,V,W,Z	1V55	0.79
TGL	TRISTEAROYLGLYCEROL	A,B,C,D,F,G, I,J,L,M,N,O, P,S,T,V,W,Y,Z	2EIN	0.79
NON	METHYL NONANOATE (ESTER)	A	1QQS	0.7
NON	METHYL NONANOATE (ESTER)	H	1CLZ	0.7
NON	METHYL NONANOATE (ESTER)	H	1CLY	0.7
L2C	(2S)-3-HYDROXY-2-(NONANOYLOXY)PROPYL LAURATE	A,C	2HVK	0.73
L2C	(2S)-3-HYDROXY-2-(NONANOYLOXY)PROPYL LAURATE	A,C	2DWD	0.73
L2C	(2S)-3-HYDROXY-2-(NONANOYLOXY)PROPYL LAURATE	C	2DWE	0.73
L2C	(2S)-3-HYDROXY-2-(NONANOYLOXY)PROPYL LAURATE	A,C	2HVJ	0.73
6UL	TETRACOSYL PALMITATE	A,B	2H26	0.7
T80	METHYLPENTA(OXYETHYL) HEPTADECANOATE	A,B	1LBT	0.74
DDR	(2S)-3-hydroxypropane-1,2-diyl didecanoate	A	2Z9Y	0.73
DDR	(2S)-3-hydroxypropane-1,2-diyl didecanoate	A	2Z9Z	0.73
1EM	(1S)-2-HYDROXY-1-[(NONANOYLOXY)METHYL]ETHYL MYRISTATE	C	2IH1	0.73
1EM	(1S)-2-HYDROXY-1-[(NONANOYLOXY)METHYL]ETHYL MYRISTATE	C	2IH3	0.73
1EM	(1S)-2-HYDROXY-1-[(NONANOYLOXY)METHYL]ETHYL MYRISTATE	A,C	2P7T	0.73
HHG	(2R)-2-HYDROXY-3-(PHOSPHONOOXY)PROPYL HEXANOATE	A	1Y9T	0.75
HHG	(2R)-2-HYDROXY-3-(PHOSPHONOOXY)PROPYL HEXANOATE	A,B	3E3C	0.75
EOD	11-[(2R,3S)-3-PENTYLOXIRAN-2-YL]UNDECANOIC ACID	A,B,C	2DIO	0.76
DGA	DIACYL GLYCEROL	A,C	2NLJ	0.72
DGA	DIACYL GLYCEROL	A,C	1ZWI	0.72
DGA	DIACYL GLYCEROL	B,C	1R3J	0.72
DGA	DIACYL GLYCEROL	C	1K4D	0.72
DGA	DIACYL GLYCEROL	A,C	1K4C	0.72
DGA	DIACYL GLYCEROL	C	1R3K	0.72
DGA	DIACYL GLYCEROL	B,C	1S5H	0.72
DGA	DIACYL GLYCEROL	C,H	1R3I	0.72
DGA	DIACYL GLYCEROL	B,C	1R3L	0.72