MMsInc Molecule/ Ligand PDB

Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02998124

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
ANX	2,5-DINITROPHENOL	A,B,C,D,E,F, G,H	2BFG	0.79
BIE	(3,4-DIHYDROXY-2-NITROPHENYL)(PHENYL)METHANONE	A,B	2CL5	0.73
NPC	4-HYDROXY-3-NITROPHENYLACETYL-EPSILON- AMINOCAPROIC ACID ANION	H,I,J	1A6V	0.75
2AF	2-AMINOPHENOL	A	1L4N	0.71
NIP	4-HYDROXY-5-IODO-3-NITROPHENYLACETYL- EPSILON-AMINOCAPROIC ACID ANION	H	1A6W	0.72
RPN	(R)-1-PARA-NITRO-PHENYL-2-AZIDO- ETHANOL	A,B,C,D	1PX0	0.74
RPN	(R)-1-PARA-NITRO-PHENYL-2-AZIDO- ETHANOL	A,B,C,D	2ZHM	0.74
RPN	(R)-1-PARA-NITRO-PHENYL-2-AZIDO- ETHANOL	A	2ZHN	0.74
NCR	2-NITRO-P-CRESOL	A,B	1AHV	0.87
DNF	2,4-DINITROPHENOL	A,B	2B16	0.79
DNF	2,4-DINITROPHENOL	H,J,L,N	1OAU	0.79
DNF	2,4-DINITROPHENOL	A	1GVO	0.79
DNF	2,4-DINITROPHENOL	A,B	2B15	0.79
DNF	2,4-DINITROPHENOL	A,B	2B14	0.79
4NS	4-nitrophenyl sulfate	X	2ZYU	0.71
TY2	3-AMINO-L-TYROSINE	A,B	2VH3	0.74
BPN	PARANITROBENZYL ALCOHOL	H,L	1YEG	0.73
NPA	2-(4-HYDROXY-3-NITROPHENYL)ACETIC ACID	H	1NGP	0.81
TNF	PICRIC ACID	A	1GVS	0.77
TNF	PICRIC ACID	X	1VYP	0.77
TNF	PICRIC ACID	A	1VYR	0.77
TNF	PICRIC ACID	X	1VYS	0.77
NTD	2-{HYDROXY[2-NITRO-4-(TRIFLUOROMETHYL)PHENYL]METHYLENE}CYCLOHEXANE- 1,3-DIONE	A,B	1T47	0.71
DNC	3,5-DINITROCATECHOL	A	3BWY	0.73
DNC	3,5-DINITROCATECHOL	A	3BWM	0.73
DNC	3,5-DINITROCATECHOL	A	1VID	0.73
4NC	4-NITROCATECHOL	A	1NO3	0.71
4NC	4-NITROCATECHOL	B	2BUU	0.71
4NC	4-NITROCATECHOL	B	2BUZ	0.71
4NC	4-NITROCATECHOL	B	1EOC	0.71
AZY	3-AZIDO-L-TYROSINE	A	2YXN	0.73
BRS	2-[1-(4-CHLORO-PHENYL)-ETHYL]-4,6- DINITRO-PHENOL	A,B,D,M,N,O,P	1KFY	0.86
NPO	P-NITROPHENOL	A,B	1Z44	0.76
NPO	P-NITROPHENOL	X	2ZYW	0.76
NPO	P-NITROPHENOL	H,L	1YEK	0.76
NPO	P-NITROPHENOL	A,C,E,G	43CA	0.76
NPO	P-NITROPHENOL	A	1LS6	0.76
NPO	P-NITROPHENOL	X	2ZVP	0.76
NPO	P-NITROPHENOL	A,B	2I10	0.76
NPO	P-NITROPHENOL	A	1VAH	0.76
NPO	P-NITROPHENOL	A,B	3ETT	0.76
NPO	P-NITROPHENOL	A,B	2D20	0.76
NPO	P-NITROPHENOL	X	2ZYV	0.76
2AC	2-AMINO-P-CRESOL	H,I	1A2C	0.78
2AC	2-AMINO-P-CRESOL	A	1L4M	0.78
GN8	(Z)-3-BENZYL-5-(2-HYDROXY-3-NITROBENZYLIDENE)- 2-THIOXOTHIAZOLIDIN-4-ONE	A,B,C,D,E,F	2P6F	0.74
DNT	2-[1-METHYLHEXYL]-4,6-DINITROPHENOL	A,B,C	1NEN	0.84
B4N	bis(4-nitrophenyl) hydrogen phosphate	A	3DH8	0.74
NIY	META-NITRO-TYROSINE	A	2ADP	0.81
NIY	META-NITRO-TYROSINE	A	3DIV	0.81
NIY	META-NITRO-TYROSINE	A	2H5U	0.81
NIY	META-NITRO-TYROSINE	A	1K4Q	0.81
NIY	META-NITRO-TYROSINE	B,G,O,Y	1SDA	0.81