Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02309439
You can sort the columns by Ligand, Ligand name, PDB and Tanimoto.
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 |
DEA![]() | D-ERITADENINE | A,B,C,D,E,F, G,H | 1K0U | 0.72 | ![]() |
G36![]() | O6-ETHYL-2'-DEOXYGUANOSINE-5'-MONOPHOSPHATE | A,B | 1D85 | 0.75 | ![]() |
G36![]() | O6-ETHYL-2'-DEOXYGUANOSINE-5'-MONOPHOSPHATE | A,B | 130D | 0.75 | ![]() |
G36![]() | O6-ETHYL-2'-DEOXYGUANOSINE-5'-MONOPHOSPHATE | A,B | 144D | 0.75 | ![]() |
G36![]() | O6-ETHYL-2'-DEOXYGUANOSINE-5'-MONOPHOSPHATE | A,B | 128D | 0.75 | ![]() |
5HG![]() | {[2-(6-AMINO-9H-PURIN-9-YL)ETHOXY]METHYL}PHOSPHONIC ACID | A,B | 2G1A | 0.74 | ![]() |
A66![]() | 2-AMINOETHYLLYSINE-CARBONYLMETHYLENE- ADENINE | B | 1NR8 | 0.71 | ![]() |
UN4![]() | 5-{[(2-AMINO-9H-PURIN-6-YL)OXY]METHYL}- 2-PYRROLIDINONE | A | 1H0V | 0.74 | ![]() |
EMA![]() | (ADENIN-9-YL-ETHOXYMETHYL)-HYDROXYPHOSPHINYL- DIPHOSPHATE | A,B | 1ZOT | 0.73 | ![]() |
EMA![]() | (ADENIN-9-YL-ETHOXYMETHYL)-HYDROXYPHOSPHINYL- DIPHOSPHATE | A,B,C,D,E,F | 1PK0 | 0.73 | ![]() |
CMG![]() | 6-O-CYCLOHEXYLMETHYL GUANINE | A,C | 1H1P | 0.73 | ![]() |
CMG![]() | 6-O-CYCLOHEXYLMETHYL GUANINE | A | 1E1V | 0.73 | ![]() |
DOI![]() | 9-(2-DEOXY-5-O-PHOSPHONO-BETA-D- ERYTHRO-PENTOFURANOSYL)-6-(PHOSPHONOOXY)- 9H-PURINE | A | 2DGN | 0.71 | ![]() |
DOI![]() | 9-(2-DEOXY-5-O-PHOSPHONO-BETA-D- ERYTHRO-PENTOFURANOSYL)-6-(PHOSPHONOOXY)- 9H-PURINE | A | 2GCQ | 0.71 | ![]() |
5AD![]() | 5'-DEOXYADENOSINE | A,B,C,D | 1I9C | 0.7 | ![]() |
5AD![]() | 5'-DEOXYADENOSINE | B | 1XRS | 0.7 | ![]() |
5AD![]() | 5'-DEOXYADENOSINE | A,B,C | 2CC2 | 0.7 | ![]() |
5AD![]() | 5'-DEOXYADENOSINE | A,B | 2FB3 | 0.7 | ![]() |
5AD![]() | 5'-DEOXYADENOSINE | A | 3CI3 | 0.7 | ![]() |
5AD![]() | 5'-DEOXYADENOSINE | A,B,C,D | 4REQ | 0.7 | ![]() |
SAI![]() | S-ADENOSYL-L-HOMOSELENOCYSTEINE | A,B | 2AVN | 0.7 | ![]() |
SAI![]() | S-ADENOSYL-L-HOMOSELENOCYSTEINE | A | 1XTP | 0.7 | ![]() |
SAI![]() | S-ADENOSYL-L-HOMOSELENOCYSTEINE | A,B | 1IM8 | 0.7 | ![]() |
EEM![]() | [(3S)-3-amino-4-hydroxy-4-oxo-butyl]- [[(2S,3S,4R,5R)-5-(6-aminopurin- 9-yl)-3,4-dihydroxy-oxolan-2-yl]methyl]- methyl-selanium | A | 3E5F | 0.71 | ![]() |
BOA![]() | 2-BROMO-6-HYDROXY-PURINE | A | 1M67 | 0.71 | ![]() |
9PP![]() | 2,6-DIAMINO-(S)-9-[2-(PHOSPHONOMETHOXY)PROPYL]PURINE | A,B,C,D,E,F | 1LVU | 0.73 | ![]() |
9PP![]() | 2,6-DIAMINO-(S)-9-[2-(PHOSPHONOMETHOXY)PROPYL]PURINE | A,B,C,D,E,F | 1LV8 | 0.73 | ![]() |
TNV![]() | [2-(6-AMINO-9H-PURIN-9-YL)-1-METHYLETHOXY]METHYL- TRIPHOSPHATE | A,B,P | 1T05 | 0.72 | ![]() |
9MG![]() | 9-METHYLGUANINE | A | 1RRW | 0.78 | ![]() |
IMO![]() | 6-O-PHOSPHORYL INOSINE MONOPHOSPHATE | A | 1CG1 | 0.7 | ![]() |
IMO![]() | 6-O-PHOSPHORYL INOSINE MONOPHOSPHATE | A | 1CG4 | 0.7 | ![]() |
IMO![]() | 6-O-PHOSPHORYL INOSINE MONOPHOSPHATE | A | 1CG3 | 0.7 | ![]() |
IMO![]() | 6-O-PHOSPHORYL INOSINE MONOPHOSPHATE | A | 1LON | 0.7 | ![]() |
IMO![]() | 6-O-PHOSPHORYL INOSINE MONOPHOSPHATE | A,B | 1LNY | 0.7 | ![]() |
IMO![]() | 6-O-PHOSPHORYL INOSINE MONOPHOSPHATE | A | 1CG0 | 0.7 | ![]() |
IMO![]() | 6-O-PHOSPHORYL INOSINE MONOPHOSPHATE | A | 1P9B | 0.7 | ![]() |
6OG![]() | A,B,C,D,E,F | 2HHW | 0.76 | ![]() | |
6OG![]() | A,B,C,D,E,F | 2HVH | 0.76 | ![]() | |
6OG![]() | A,B | 1D24 | 0.76 | ![]() | |
6OG![]() | A,T | 2J6S | 0.76 | ![]() | |
6OG![]() | A,C | 2HW3 | 0.76 | ![]() | |
6OG![]() | A,T | 2J6T | 0.76 | ![]() | |
6OG![]() | A,P,T | 2J6U | 0.76 | ![]() | |
6OG![]() | A,C | 2HHT | 0.76 | ![]() | |
6OG![]() | A,B | 218D | 0.76 | ![]() | |
6OG![]() | A,C | 2HHX | 0.76 | ![]() | |
6OG![]() | A,B | 2HHQ | 0.76 | ![]() | |
6OG![]() | A,C | 2HHV | 0.76 | ![]() | |
6OG![]() | A,B,E | 2O8C | 0.76 | ![]() | |
6OG![]() | A,B | 153D | 0.76 | ![]() | |
6OG![]() | B | 1T38 | 0.76 | ![]() | |
6OG![]() | A,B | 2HHS | 0.76 | ![]() | |
6OG![]() | A,C | 2HHU | 0.76 | ![]() | |
6OG![]() | A,B | 1D27 | 0.76 | ![]() | |
SA8![]() | S-5'-AZAMETHIONINE-5'-DEOXYADENOSINE | A,B,C | 2C4T | 0.7 | ![]() |
SA8![]() | S-5'-AZAMETHIONINE-5'-DEOXYADENOSINE | A | 1Z3C | 0.7 | ![]() |
SA8![]() | S-5'-AZAMETHIONINE-5'-DEOXYADENOSINE | A,B,C | 2H2E | 0.7 | ![]() |
ZAD![]() | (S)-1'-(2',3'-DIHYDROXYPROPYL)- ADENINE | A | 2JJA | 0.72 | ![]() |
ARP![]() | 9-HYDROXYPROPYLADENINE, R-ISOMER | A,B | 1E2I | 0.76 | ![]() |
APS![]() | 9-HYDROXYPROPYLADENINE, S-ISOMER | A,B | 1E2I | 0.76 | ![]() |
CC5![]() | BETA-D-ERYTHROFURANOSYL-ADENOSINE | A | 2I2B | 0.71 | ![]() |
CC5![]() | BETA-D-ERYTHROFURANOSYL-ADENOSINE | A,B,C | 2CBX | 0.71 | ![]() |
MBP![]() | 1-[(2-AMINO-6,9-DIHYDRO-1H-PURIN- 6-YL)OXY]-3-METHYL-2-BUTANOL | A | 1GZ8 | 0.78 | ![]() |
6GO![]() | 6-O-methylguanine | A | 3FO6 | 0.82 | ![]() |
6GO![]() | 6-O-methylguanine | A | 3GES | 0.82 | ![]() |
PPZ![]() | 2-(PYRIDO[1,2-E]PURIN-4-YL)AMINO- ETHANOL | A,B | 1I5V | 0.71 | ![]() |
NOS![]() | INOSINE | A,B,C | 1PR0 | 0.72 | ![]() |
NOS![]() | INOSINE | A,B | 1KIC | 0.72 | ![]() |
NOS![]() | INOSINE | A,B,C,D | 3B9X | 0.72 | ![]() |
NOS![]() | INOSINE | E | 1RCT | 0.72 | ![]() |
NOS![]() | INOSINE | A | 2FQW | 0.72 | ![]() |
NOS![]() | INOSINE | A | 1Z38 | 0.72 | ![]() |
NOS![]() | INOSINE | A | 1A9S | 0.72 | ![]() |
NOS![]() | INOSINE | A | 2BSX | 0.72 | ![]() |
APN![]() | 2-AMINOETHYLGLYCINE-CARBONYLMETHYLENE- ADENINE | A,B,C,D,E,F, G,H | 1QPY | 0.78 | ![]() |
APN![]() | 2-AMINOETHYLGLYCINE-CARBONYLMETHYLENE- ADENINE | A,B | 1RRU | 0.78 | ![]() |
APN![]() | 2-AMINOETHYLGLYCINE-CARBONYLMETHYLENE- ADENINE | B | 1PDT | 0.78 | ![]() |
APN![]() | 2-AMINOETHYLGLYCINE-CARBONYLMETHYLENE- ADENINE | A,B | 1PUP | 0.78 | ![]() |
APN![]() | 2-AMINOETHYLGLYCINE-CARBONYLMETHYLENE- ADENINE | B | 1NR8 | 0.78 | ![]() |
APN![]() | 2-AMINOETHYLGLYCINE-CARBONYLMETHYLENE- ADENINE | A,B | 1XJ9 | 0.78 | ![]() |
APN![]() | 2-AMINOETHYLGLYCINE-CARBONYLMETHYLENE- ADENINE | A | 176D | 0.78 | ![]() |
APN![]() | 2-AMINOETHYLGLYCINE-CARBONYLMETHYLENE- ADENINE | A,B,C,D | 1HZS | 0.78 | ![]() |
APN![]() | 2-AMINOETHYLGLYCINE-CARBONYLMETHYLENE- ADENINE | A,B | 2K4G | 0.78 | ![]() |
TFO![]() | [2-(6-AMINO-9H-PURIN-9-YL)-1-METHYLETHOXY]METHYLPHOSPHONIC ACID | A,P | 1T03 | 0.74 | ![]() |