Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00268438
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 |
CS3![]() | S-[3-OXO-3-(2-THIENYL)PROPYL]-L- CYSTEINE | A | 2OQW | 0.74 | ![]() |
CTB![]() | N-2-THIOPHEN-2-YL-ACETAMIDE BORONIC ACID | A,B | 1FSW | 0.71 | ![]() |
CEP![]() | CEPHALOTHIN GROUP | A | 1CEG | 0.71 | ![]() |
CEP![]() | CEPHALOTHIN GROUP | A | 1IYP | 0.71 | ![]() |
THN![]() | 2-[CARBOXY-(2-THIOPHEN-2-YL-ACETYLAMINO)- METHYL]-5-METHYLENE-5,6-DIHYDRO- 2H-[1,3]THIAZINE-4-CARBOXYLIC ACID | A,B | 1KVL | 0.7 | ![]() |
NCF![]() | (2R)-2-{(1R)-2-OXO-1-[(2-THIENYLACETYL)AMINO]ETHYL}- 5,6-DIHYDRO-2H-1,3-THIAZINE-4-CARBOXYLIC ACID | A,B,C,D | 1W8Y | 0.7 | ![]() |
TIH![]() | BETA(2-THIENYL)ALANINE | A | 1MMK | 0.7 | ![]() |
TIH![]() | BETA(2-THIENYL)ALANINE | B | 1EOJ | 0.7 | ![]() |
TIH![]() | BETA(2-THIENYL)ALANINE | A | 1KW0 | 0.7 | ![]() |
TIH![]() | BETA(2-THIENYL)ALANINE | A | 1BDK | 0.7 | ![]() |
SM2![]() | (1R)-1-(2-THIENYLACETYLAMINO)-1- (3-CARBOXYPHENYL)METHYLBORONIC ACID | A,B | 1PI5 | 0.7 | ![]() |
SM2![]() | (1R)-1-(2-THIENYLACETYLAMINO)-1- (3-CARBOXYPHENYL)METHYLBORONIC ACID | A | 1NXY | 0.7 | ![]() |
SM2![]() | (1R)-1-(2-THIENYLACETYLAMINO)-1- (3-CARBOXYPHENYL)METHYLBORONIC ACID | A,B | 1MXO | 0.7 | ![]() |
SM2![]() | (1R)-1-(2-THIENYLACETYLAMINO)-1- (3-CARBOXYPHENYL)METHYLBORONIC ACID | A,B | 1YM1 | 0.7 | ![]() |