Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00006040
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 |
AIO | [(2R)-1-(L-ALANYL-L-ISOLEUCYL)PYRROLIDIN- 2-YL]BORONIC ACID | A | 2EEP | 0.75 | |
AIO | [(2R)-1-(L-ALANYL-L-ISOLEUCYL)PYRROLIDIN- 2-YL]BORONIC ACID | A | 2Z3Z | 0.75 | |
GIO | CYCLO-(GLYCINE-L-PROLINE) INHIBITOR | A,B | 1W1P | 0.75 | |
VLM | VALINYLAMINE | G,M,P,S | 1YYM | 0.73 | |
VLM | VALINYLAMINE | G,M,P,S | 2I5Y | 0.73 | |
VLM | VALINYLAMINE | G,M,P,S | 1YYL | 0.73 | |
VLM | VALINYLAMINE | G,M,P,S | 2I60 | 0.73 | |
CIB | 2-ACETYLAMINO-4-METHYL-PENTANOIC ACID [1- (1-FORMYL-PENTYLCARBAMOYL)-3-METHYL- BUTYL]-AMIDE | H,I,J,K,L,M,N | 1J2Q | 0.71 | |
MNV | N-METHYL-C-AMINO VALINE | C | 1CWJ | 0.85 | |
CDX | (S)-4,4'-(1-METHYL-1,2-ETHANEDIYL)BIS- 2,6-PIPERAZINEDIONE | A,B | 1QZR | 0.7 | |
PPL | PIPERIDINE-2-CARBOXYLIC ACID TERT- BUTYLAMIDE | A,B | 1IDB | 0.79 | |
PPL | PIPERIDINE-2-CARBOXYLIC ACID TERT- BUTYLAMIDE | A,B | 1IDA | 0.79 | |
BUM | 2-AMINO-N,3,3-TRIMETHYLBUTANAMIDE | A,B | 1GKC | 0.78 | |
BUM | 2-AMINO-N,3,3-TRIMETHYLBUTANAMIDE | A,B | 1GKD | 0.78 | |
A3M | 2-AMINO-3-METHYL-1-PYRROLIDIN-1- YL-BUTAN-1-ONE | A,B | 1N1M | 0.78 |