MMsInc Molecule/ Ligand PDB

Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02436310

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
NPO	P-NITROPHENOL	A,B	1Z44	0.74
NPO	P-NITROPHENOL	X	2ZYW	0.74
NPO	P-NITROPHENOL	H,L	1YEK	0.74
NPO	P-NITROPHENOL	A,C,E,G	43CA	0.74
NPO	P-NITROPHENOL	A	1LS6	0.74
NPO	P-NITROPHENOL	X	2ZVP	0.74
NPO	P-NITROPHENOL	A,B	2I10	0.74
NPO	P-NITROPHENOL	A	1VAH	0.74
NPO	P-NITROPHENOL	A,B	3ETT	0.74
NPO	P-NITROPHENOL	A,B	2D20	0.74
NPO	P-NITROPHENOL	X	2ZYV	0.74
145	1-O-[O-NITROPHENYL]-BETA-D-GALACTOPYRANOSE	A,B,C	2PE5	0.74
145	1-O-[O-NITROPHENYL]-BETA-D-GALACTOPYRANOSE	A,B,C,D	1JYV	0.74
NFG	2,4-DINITROPHENYL 2-DEOXY-2-FLUORO- BETA-D-GLUCOPYRANOSIDE	A	2PB1	0.71
NFG	2,4-DINITROPHENYL 2-DEOXY-2-FLUORO- BETA-D-GLUCOPYRANOSIDE	A	1E4I	0.71
NFG	2,4-DINITROPHENYL 2-DEOXY-2-FLUORO- BETA-D-GLUCOPYRANOSIDE	A	1UYQ	0.71
NIM	4-NITRO-2-PHENOXYMETHANESULFONANILIDE	A	1ZWP	0.78
NIM	4-NITRO-2-PHENOXYMETHANESULFONANILIDE	A	3E9X	0.78
NIM	4-NITRO-2-PHENOXYMETHANESULFONANILIDE	A	2OTH	0.78
NPF	ORTHONITROPHENYL-BETA-D-FUCOPYRANOSIDE	A,B,C	1EFA	0.75
NPF	ORTHONITROPHENYL-BETA-D-FUCOPYRANOSIDE	A,B	2PAF	0.75
NPF	ORTHONITROPHENYL-BETA-D-FUCOPYRANOSIDE	A,B,C	1JWL	0.75
B4N	bis(4-nitrophenyl) hydrogen phosphate	A	3DH8	0.72
4NS	4-nitrophenyl sulfate	X	2ZYU	0.75
DNF	2,4-DINITROPHENOL	A,B	2B16	0.75
DNF	2,4-DINITROPHENOL	H,J,L,N	1OAU	0.75
DNF	2,4-DINITROPHENOL	A	1GVO	0.75
DNF	2,4-DINITROPHENOL	A,B	2B15	0.75
DNF	2,4-DINITROPHENOL	A,B	2B14	0.75
KHP	2-HYDROXYMETHYL-5-(4-NITRO-PHENOXY)- TETRAHYDRO-FURAN-3,4-DIOL	A,B	1QW9	0.7
EPN	3-(4-NITRO-PHENOXY)-PROPAN-1-OL	A	2SAM	0.78
M2F	2,4-DINITROPHENYL 2-DEOXY-2-FLUORO- BETA-D-MANNOPYRANOSIDE	A,B	2WBK	0.71
ANX	2,5-DINITROPHENOL	A,B,C,D,E,F, G,H	2BFG	0.74
PNP	METHYL-PHOSPHONIC ACID MONO-(4- NITRO-PHENYL) ESTER	A,B,D,F	1KNO	0.73
PNP	METHYL-PHOSPHONIC ACID MONO-(4- NITRO-PHENYL) ESTER	A	1ZED	0.73
TNF	PICRIC ACID	A	1GVS	0.73
TNF	PICRIC ACID	X	1VYP	0.73
TNF	PICRIC ACID	A	1VYR	0.73
TNF	PICRIC ACID	X	1VYS	0.73
4NP	4-NITROPHENYL PHOSPHATE	A,B	1D1Q	0.72
4NP	4-NITROPHENYL PHOSPHATE	A,B	1VE7	0.72
4NP	4-NITROPHENYL PHOSPHATE	A	2I6P	0.72
NCH	P-NITROPHENYL-PHOSPHOCHOLINE	L	1DL7	0.76
NCR	2-NITRO-P-CRESOL	A,B	1AHV	0.73