MMsInc Molecule/ Ligand PDB

Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03089996

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
7RP	7-ALPHA-D-RIBOFURANOSYL-PURINE- 5'-PHOSPHATE	A	1L5L	0.71
PUR	PURINE RIBOSIDE	A	1FKW	0.7
PUR	PURINE RIBOSIDE	A	1UIP	0.7
2FE	2'-fluoro-2'-deoxy-1,N6-ethenoadenine	E,G	3CWU	0.7
CF5		A	2A3L	0.7
NEP	N1-PHOSPHONOHISTIDINE	A,B	3FDZ	0.7
NEP	N1-PHOSPHONOHISTIDINE	A,B,D,E	2NU6	0.7
NEP	N1-PHOSPHONOHISTIDINE	A	1E58	0.7
NEP	N1-PHOSPHONOHISTIDINE	A,B	1TIP	0.7
NEP	N1-PHOSPHONOHISTIDINE	A,B	2QE6	0.7
NEP	N1-PHOSPHONOHISTIDINE	A,B,C	1WVQ	0.7
NEP	N1-PHOSPHONOHISTIDINE	A,B	2HHJ	0.7
NEP	N1-PHOSPHONOHISTIDINE	A,B,D,E,F,G, H,I	2NU9	0.7
NEP	N1-PHOSPHONOHISTIDINE	A,B	1EUD	0.7
NEP	N1-PHOSPHONOHISTIDINE	A,D	1SCU	0.7
NEP	N1-PHOSPHONOHISTIDINE	A,B	2FPP	0.7
NEP	N1-PHOSPHONOHISTIDINE	A,B	2HWG	0.7
NEP	N1-PHOSPHONOHISTIDINE	A,B	1VSQ	0.7
NEP	N1-PHOSPHONOHISTIDINE	A,B	2FPI	0.7
NEP	N1-PHOSPHONOHISTIDINE	A	1QWO	0.7
NEP	N1-PHOSPHONOHISTIDINE	A,B,D,E	2SCU	0.7
NEP	N1-PHOSPHONOHISTIDINE	A,B	2FP4	0.7
IIC	4-IMIDAZOLMETHYLENE-5-IMIDAZOLONE CHROMOPHORE	A	1BFP	0.7
MHS	N1-METHYLATED HISTIDINE	A,B,C,D,E,F	1HBO	0.73
MHS	N1-METHYLATED HISTIDINE	A,C,D,F	1MRO	0.73
MHS	N1-METHYLATED HISTIDINE	A,C,D,F	1E6Y	0.73
MHS	N1-METHYLATED HISTIDINE	A,B,C,D,E,F	1HBM	0.73
MHS	N1-METHYLATED HISTIDINE	A,B,C,D,E,F	1HBN	0.73
MHS	N1-METHYLATED HISTIDINE	A,B,C,D,E,F	1HBU	0.73
P2P	N7-(5'-PHOSPHO-ALPHA-RIBOSYL)-2- HYDROXYPURINE	A	1JHR	0.71
AMZ	AMINOIMIDAZOLE 4-CARBOXAMIDE RIBONUCLEOTIDE	A,B	1P4R	0.71
AMZ	AMINOIMIDAZOLE 4-CARBOXAMIDE RIBONUCLEOTIDE	E,G	2QRE	0.71
AMZ	AMINOIMIDAZOLE 4-CARBOXAMIDE RIBONUCLEOTIDE	A,B,C,D	1PL0	0.71
AMZ	AMINOIMIDAZOLE 4-CARBOXAMIDE RIBONUCLEOTIDE	A,B	1M9N	0.71
AMZ	AMINOIMIDAZOLE 4-CARBOXAMIDE RIBONUCLEOTIDE	A,B,C,D	2NTL	0.71
AMZ	AMINOIMIDAZOLE 4-CARBOXAMIDE RIBONUCLEOTIDE	A	2UV5	0.71
AMZ	AMINOIMIDAZOLE 4-CARBOXAMIDE RIBONUCLEOTIDE	A	2R7K	0.71
AMZ	AMINOIMIDAZOLE 4-CARBOXAMIDE RIBONUCLEOTIDE	A	2R7L	0.71
AMZ	AMINOIMIDAZOLE 4-CARBOXAMIDE RIBONUCLEOTIDE	A,B	2R84	0.71
AMZ	AMINOIMIDAZOLE 4-CARBOXAMIDE RIBONUCLEOTIDE	A	2CNQ	0.71
AIR	5-AMINOIMIDAZOLE RIBONUCLEOTIDE	A	2FWJ	0.73
AIR	5-AMINOIMIDAZOLE RIBONUCLEOTIDE	A,B,C,D,L,M, N,O	1D7A	0.73
AIR	5-AMINOIMIDAZOLE RIBONUCLEOTIDE	A	2FWI	0.73
GI4	METHYL ACETIC ACID-SUBSTITUTED GLUCOIMIDAZOLE	A,B	2J7G	0.81
HIC	4-METHYL-HISTIDINE	A	2Q97	0.73
HIC	4-METHYL-HISTIDINE	A	1QZ6	0.73
HIC	4-METHYL-HISTIDINE	A	3CHW	0.73
HIC	4-METHYL-HISTIDINE	A,B	2GWK	0.73
HIC	4-METHYL-HISTIDINE	A,B,D,E	1MDU	0.73
HIC	4-METHYL-HISTIDINE	A	2ASO	0.73
HIC	4-METHYL-HISTIDINE	A,B	2D1K	0.73
HIC	4-METHYL-HISTIDINE	A,S	1C0F	0.73
HIC	4-METHYL-HISTIDINE	A,D	1ATN	0.73
HIC	4-METHYL-HISTIDINE	A,B	2A42	0.73
HIC	4-METHYL-HISTIDINE	A,P	2BTF	0.73
HIC	4-METHYL-HISTIDINE	A,B	1LOT	0.73
HIC	4-METHYL-HISTIDINE	A	1NWK	0.73
HIC	4-METHYL-HISTIDINE	A,S	1C0G	0.73
HIC	4-METHYL-HISTIDINE	A,S	1EQY	0.73
HIC	4-METHYL-HISTIDINE	A	2PAV	0.73
HIC	4-METHYL-HISTIDINE	A	2Q0U	0.73
HIC	4-METHYL-HISTIDINE	A,B	2HMP	0.73
HIC	4-METHYL-HISTIDINE	A	2PBD	0.73
HIC	4-METHYL-HISTIDINE	A,S	1DEJ	0.73
HIC	4-METHYL-HISTIDINE	A,S	1ESV	0.73
HIC	4-METHYL-HISTIDINE	A	1J6Z	0.73
HIC	4-METHYL-HISTIDINE	A	1WUA	0.73
HIC	4-METHYL-HISTIDINE	A,B	1YXQ	0.73
HIC	4-METHYL-HISTIDINE	A	1S22	0.73
HIC	4-METHYL-HISTIDINE	A,B,D,E	2A40	0.73
HIC	4-METHYL-HISTIDINE	A	1QZ5	0.73
HIC	4-METHYL-HISTIDINE	A	2ZWH	0.73
HIC	4-METHYL-HISTIDINE	A,B	2A41	0.73
HIC	4-METHYL-HISTIDINE	B	1MA9	0.73
HIC	4-METHYL-HISTIDINE	A,G	3CI5	0.73
HIC	4-METHYL-HISTIDINE	A	1Y64	0.73
HIC	4-METHYL-HISTIDINE	A,P	1HLU	0.73
HIC	4-METHYL-HISTIDINE	A,B	2A3Z	0.73
HIC	4-METHYL-HISTIDINE	A	2FXU	0.73
HIC	4-METHYL-HISTIDINE	A,G	3CIP	0.73
HIC	4-METHYL-HISTIDINE	A	2GWJ	0.73
HIC	4-METHYL-HISTIDINE	A,B	2VCP	0.73
HRB	N-ACETYL-1-[(2R,3S,5R)-5-HYDROXY- 2-PENTYLTETRAHYDROFURAN-3-YL]-L- HISTIDINE	H,L	2DDQ	0.74
MTU	9-BETA-D-RIBOFURANOSYL-9H-PURIN- 2-AMINE	A,C	1T0D	0.71
MTU	9-BETA-D-RIBOFURANOSYL-9H-PURIN- 2-AMINE	B,D	2BCY	0.71
MTU	9-BETA-D-RIBOFURANOSYL-9H-PURIN- 2-AMINE	A,B,C	3BBI	0.71
MTU	9-BETA-D-RIBOFURANOSYL-9H-PURIN- 2-AMINE	A,B,C	3B91	0.71
C2R	5-AMINO-1-(5-O-PHOSPHONO-BETA-D- RIBOFURANOSYL)-1H-IMIDAZOLE-4-CARBOXYLIC ACID	A	2NSJ	0.74
C2R	5-AMINO-1-(5-O-PHOSPHONO-BETA-D- RIBOFURANOSYL)-1H-IMIDAZOLE-4-CARBOXYLIC ACID	A,B	2GQS	0.74
C2R	5-AMINO-1-(5-O-PHOSPHONO-BETA-D- RIBOFURANOSYL)-1H-IMIDAZOLE-4-CARBOXYLIC ACID	A	2NSL	0.74
HIQ	1-[1,2-DIHYDROXY-1-(HYDROXYMETHYL)ETHYL]- L-HISTIDINE	A,B	2IU4	0.81
AIS	5-AMINOIMIDAZOLE RIBONUCLEOSIDE	A,B	1TZ6	0.76
AIS	5-AMINOIMIDAZOLE RIBONUCLEOSIDE	A,B	1TZ3	0.76
P5P		A,B	1MV6	0.71
P5P		A,B	1MV1	0.71
P5P		A,B	1MV2	0.71
P5P		B	1XV0	0.71
P5P		A	1RBN	0.71
D33	1-(2-deoxy-5-O-phosphono-beta-D- erythro-pentofuranosyl)-1H-imidazole	A	2K69	0.73
D33	1-(2-deoxy-5-O-phosphono-beta-D- erythro-pentofuranosyl)-1H-imidazole	A	2K68	0.73
D33	1-(2-deoxy-5-O-phosphono-beta-D- erythro-pentofuranosyl)-1H-imidazole	A	2K67	0.73
7RA	7-ALPHA-D-RIBOFURANOSYL-2-AMINOPURINE- 5'-PHOSPHATE	A	1L5M	0.71
DHI	D-HISTIDINE	P	1MCB	0.7
DHI	D-HISTIDINE	A	2EZ7	0.7
DHI	D-HISTIDINE	P	1MCN	0.7
DHI	D-HISTIDINE	A,D	1CZQ	0.7
DHI	D-HISTIDINE	I	1ER8	0.7
DHI	D-HISTIDINE	P	1MCL	0.7
DHI	D-HISTIDINE	A,B,C,D	3BOG	0.7
DHI	D-HISTIDINE	A,L	1ZEA	0.7
GMP	GUANOSINE	A	2GBH	0.7
GMP	GUANOSINE	A	1IH7	0.7
GMP	GUANOSINE	A	2QVN	0.7
GMP	GUANOSINE	A,B	1WAF	0.7
GMP	GUANOSINE	A,B,C,D,E,F	1JE1	0.7
GMP	GUANOSINE	A	3DMH	0.7
GMP	GUANOSINE	E	1RFG	0.7
GMP	GUANOSINE	A	2FQX	0.7
GMP	GUANOSINE	A	3CFO	0.7
GMP	GUANOSINE	A,B	2AN9	0.7
GMP	GUANOSINE	A,B,C,D,E,F	1ODJ	0.7
MH1	1-methyl-L-histidine	A,B	3G88	0.73
MH1	1-methyl-L-histidine	A,B	3G89	0.73
MH1	1-methyl-L-histidine	A,B,C,D,E,F	3G8A	0.73
DCF	2'-DEOXYCOFORMYCIN	A,B,C,D	1A4L	0.73
DCF	2'-DEOXYCOFORMYCIN	A	2PGR	0.73
IRN	1-(5-O-phosphono-beta-D-ribofuranosyl)- 1H-imidazole	A	3EPN	0.75
GI2	METHYL ACETATE-SUBSTITUTED GLUCOIMIDAZOLE	A,B	2J7E	0.81
720	(2S)-5-AMINO-2-[(1-PROPYL-1H-IMIDAZOL- 4-YL)METHYL]PENTANOIC ACID	A	2JEW	0.72
SNI	9-(3,4-DIHYDROXY-5-HYDROXYMETHYL- TETRAHYDRO-FURAN-2-YL)-1,9-DIHYDRO- PURINE-6-THIONE	A,B,C	1S3F	0.72
EDA	3-[2-DEOXY-RIBOFURANOSYL]-3H-1,3,4,5A,8- PENTAAZA-AS-INDACENE-5'-MONOPHOSPHATE	A,B	150D	0.71
EDA	3-[2-DEOXY-RIBOFURANOSYL]-3H-1,3,4,5A,8- PENTAAZA-AS-INDACENE-5'-MONOPHOSPHATE	A,P,T	2DPJ	0.71
EDA	3-[2-DEOXY-RIBOFURANOSYL]-3H-1,3,4,5A,8- PENTAAZA-AS-INDACENE-5'-MONOPHOSPHATE	A,P,T	2DPI	0.71
EDA	3-[2-DEOXY-RIBOFURANOSYL]-3H-1,3,4,5A,8- PENTAAZA-AS-INDACENE-5'-MONOPHOSPHATE	A,D	1EWN	0.71
EDA	3-[2-DEOXY-RIBOFURANOSYL]-3H-1,3,4,5A,8- PENTAAZA-AS-INDACENE-5'-MONOPHOSPHATE	A,D	1F4R	0.71
13A	7-(3,4-DIHYDROXY-5R-HYDROXYMETHYLTETRAHYDROFURAN- 2-YL)-2,2-DIOXO-1,2R,3R,7-TETRAHYDRO- 2L6-IMIDAZO[4,5-C][1,2,6]THIADIAZIN- 4S-ONE	A,B,C,D	2B1G	0.7
XXY	2-[(1R,2R)-1-amino-2-hydroxypropyl]- 1-(carboxymethyl)-4-(1H-imidazol- 5-ylmethyl)-1H-imidazol-5-olate	A	2FWQ	0.71
PR5		B	2DD2	0.71
PR5		B	2DD1	0.71
PR5		B	2DD3	0.71
PR5		A,B,C,D,E,F, G,H	2B3J	0.71