Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02418218
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 |
GR3![]() | 3-ACETOXY-17-(1-FORMYL-5-METHYL- 3-OXO-HEX-4-ENYL)-16-HYDROXY-4,10,13,14- TETRAMETHYL-2,3,4,5,6,9,10,11,12,13,14,15,16,17- TETRADECAHYDRO-1H-CYCLOPENTA[A]PHENANTHRENE- 4-CARBOXYLIC ACID | B,D | 1AWH | 0.7 | ![]() |
NTH![]() | SUCCINIC ACID MONO-(13-METHYL-3- OXO-2,3,6,7,8,9,10,11,12,13,14,15,16,17- TETRADECAHYDRO-1H-CYCLOPENTA[A]PHENANTHREN- 17-YL) ESTER | A,B | 1BUQ | 0.74 | ![]() |
TH2![]() | TESTOSTERONE HEMISUCCINATE | A,B | 2CBT | 0.75 | ![]() |
TH2![]() | TESTOSTERONE HEMISUCCINATE | A,B,C,D,E,F | 2CBQ | 0.75 | ![]() |
TH2![]() | TESTOSTERONE HEMISUCCINATE | A | 2CBO | 0.75 | ![]() |
FUA![]() | FUSIDIC ACID | A | 1QCA | 0.77 | ![]() |
FUA![]() | FUSIDIC ACID | A,B,C,D,E,F, G,H,I,J,K,L | 1Q23 | 0.77 | ![]() |
FUA![]() | FUSIDIC ACID | A,B | 2VUF | 0.77 | ![]() |
CLL![]() | CHOLESTERYL LINOLEATE | A,B | 1CLE | 0.8 | ![]() |
C3S![]() | CHOLEST-5-EN-3-YL HYDROGEN SULFATE | A | 1S0X | 0.73 | ![]() |
C3S![]() | CHOLEST-5-EN-3-YL HYDROGEN SULFATE | A | 2Q9F | 0.73 | ![]() |
C3S![]() | CHOLEST-5-EN-3-YL HYDROGEN SULFATE | A,B,C | 2HKA | 0.73 | ![]() |
KH1![]() | 5-(2-{1-[1-(4-ETHYL-4-HYDROXY-HEXYLOXY)- ETHYL]-7A-METHYL-OCTAHYDRO-INDEN- 4-YLIDENE}-ETHYLIDENE)-4-METHYLENE- CYCLOHEXANE-1,3-DIOL | A | 1IE8 | 0.7 | ![]() |
FUG![]() | FUMAGILLIN | A,B | 3FMQ | 0.71 | ![]() |
FUG![]() | FUMAGILLIN | A | 1BOA | 0.71 | ![]() |
DL4![]() | (14beta,17alpha,25R)-3-oxocholest- 4-en-26-oic acid | A | 3GYT | 0.7 | ![]() |
CLR![]() | CHOLESTEROL | A,B | 2ZXE | 0.72 | ![]() |
CLR![]() | CHOLESTEROL | A | 1N83 | 0.72 | ![]() |
CLR![]() | CHOLESTEROL | A | 2RH1 | 0.72 | ![]() |
CLR![]() | CHOLESTEROL | A | 1LRI | 0.72 | ![]() |
CLR![]() | CHOLESTEROL | A | 1ZHY | 0.72 | ![]() |
CLR![]() | CHOLESTEROL | A | 3D4S | 0.72 | ![]() |
2OB![]() | CHOLESTERYL OLEATE | A | 2OBD | 0.8 | ![]() |
DOG![]() | DIGOXIGENIN | A | 1LKE | 0.77 | ![]() |
DTX![]() | DIGITOXIGENIN | A | 1LNM | 0.78 | ![]() |
HC3![]() | 25-HYDROXYCHOLESTEROL | A | 1ZHX | 0.72 | ![]() |
PLO![]() | (3BETA)-3-HYDROXYPREGN-5-EN-20- ONE | A | 1Q20 | 0.7 | ![]() |
HC2![]() | 20-HYDROXYCHOLESTEROL | A | 1ZHW | 0.72 | ![]() |
ERG![]() | ERGOSTEROL | A | 1BXM | 0.75 | ![]() |
ERG![]() | ERGOSTEROL | A | 1ZHZ | 0.75 | ![]() |
ERG![]() | ERGOSTEROL | A,B | 2AIB | 0.75 | ![]() |
CO1![]() | 17-[3-(3,3-DIMETHYL-OXIRANYL)-1- METHYL-PROPYL]-10,13-DIMETHYL-2,3,4,7,8,9,10,11,12,13,14,15,16,17- TETRADECAHYDRO-1H-CYCLOPENTA[A]PHENANTHREN- 3-OL | A,B | 1P8D | 0.73 | ![]() |
SIH![]() | PROGESTERONE-11-ALPHA-OL-HEMISUCCINATE | H | 1DBM | 0.74 | ![]() |
PID![]() | PERIDININ | A | 2C9E | 0.75 | ![]() |
PID![]() | PERIDININ | M,N,O | 1PPR | 0.75 | ![]() |
HCR![]() | 7-HYDROXYCHOLESTEROL | A | 1ZHT | 0.74 | ![]() |