+Open data
-Basic information
Entry | Database: PDB chemical components / ID: PX9 |
---|---|
Name | Name: |
-Chemical information
Composition | Formula: C17H27NO3 / Number of atoms: 48 / Formula weight: 293.401 / Formal charge: 0 | ||||
---|---|---|---|---|---|
Others | Type: NON-POLYMER / PDB classification: HETAIN / Three letter code: PX9 / Ideal coordinates details: Corina / Model coordinates PDB-ID: 4Y0Q | ||||
History |
| ||||
External links | UniChem / ChemSpider / BindingDB / ChEBI / ChEMBL / ChemicalBook / CompTox / DailyMed / DrugBank / KEGG_Ligand / Nikkaji / PubChem / PubChem_TPharma / SureChEMBL / ZINC / Wikipedia search / Google search |
-Structure visualization
Structure viewer | Molecule: MolmilJmol/JSmol |
---|
-Details
-SMILES
ACDLabs 12.01 | CACTVS 3.385 | OpenEye OEToolkits 1.9.2 | |
---|
-SMILES CANONICAL
CACTVS 3.385 | OpenEye OEToolkits 1.9.2 | |
---|
-InChI
InChI 1.03 |
---|
-InChIKey
InChI 1.03 |
---|
-SYSTEMATIC NAME
ACDLabs 12.01 | OpenEye OEToolkits 1.9.2 | |
---|
-PDB entries
Showing all 6 items
PDB-4y0q:
Bovine beta-lactoglobulin complex with pramocaine crystallized from sodium citrate (BLG-PRM1)
PDB-4y0r:
Bovine beta-lactoglobulin complex with pramocaine crystallized from ammonium sulphate (BLG-PRM2)
PDB-4y0s:
Goat beta-lactoglobulin complex with pramocaine (GLG-PRM)
PDB-7z9z:
Mutant L39Y of recombinant bovine beta-lactoglobulin in complex with pramocaine
PDB-7za0:
Mutant L58F of recombinant bovine beta-lactoglobulin in complex with pramocaine
PDB-7zcd:
Mutant L39Y-L58F of recombinant bovine beta-lactoglobulin in complex with pramocaine