Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs01534387
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 |
SM4 | (1R)-1-(2-THIOPHEN-2-YL-ACETYLAMINO)- 1-(3-(2-CARBOXYVINYL)-PHENYL) METHYLBORONIC ACID | A,B | 2RCX | 0.71 | |
4TB | 4-(2-THIENYL)BUTYRIC ACID | A,B | 2AY8 | 0.72 | |
C21 | THIOPHENE-2-CARBOXYLIC ACID | A,B | 2HDQ | 0.7 | |
BZB | BENZO[B]THIOPHENE-2-BORONIC ACID | A,B | 3FKV | 0.77 | |
BZB | BENZO[B]THIOPHENE-2-BORONIC ACID | A,B | 1C3B | 0.77 | |
ARL | 7-(3,5-DITERT-BUTYLPHENYL)-3-METHYLOCTA- 2,4,6-TRIENOIC ACID | A | 1NQ7 | 0.71 | |
GW5 | (2E)-3-{4-[(1E)-1,2-DIPHENYLBUT- 1-ENYL]PHENYL}ACRYLIC ACID | A,B,C | 1R5K | 0.73 | |
CVB | 4-(CARBOXYVIN-2-YL)PHENYLBORONIC ACID | A,B | 1KE0 | 0.76 | |
RS7 | (2E)-3-(2-OCT-1-YN-1-YLPHENYL)ACRYLIC ACID | A,B | 2P0M | 0.71 | |
RS7 | (2E)-3-(2-OCT-1-YN-1-YLPHENYL)ACRYLIC ACID | A | 1LOX | 0.71 | |
ISF | A,B | 1PGE | 0.76 | ||
TCA | PHENYLETHYLENECARBOXYLIC ACID | A | 1BE6 | 0.77 | |
TCA | PHENYLETHYLENECARBOXYLIC ACID | A | 1BE8 | 0.77 | |
TCA | PHENYLETHYLENECARBOXYLIC ACID | A,B,C,D,E,F, G,H | 2O78 | 0.77 |