DrugDomain logoDrugDomain

Attributes

UniProt ID
Protein Name
Beta-lactamase
Ligand Name
(3~{S})-2,2-bis(oxidanyl)-3-(phenylmethylsulfanyl)-3,4-dihydro-1,2-benzoxaborinin-2-ium-8-carboxylic acid
DrugBank ID
None
PDB Ligand Accession
ChEMBL ID
n/a
PubChem ID
n/a
InChIKey
NCOFNSDHLWCKKT-CQSZACIVSA-N
SMILES
[B-]1(C(Cc2cccc(c2O1)C(=O)O)SCc3ccccc3)(O)O
Drug Action
No data available
Affinity Metrics
No affinity data available

3D Structure

Interactive Mol* view for the current protein-molecule pair.

Structure: 6RPN
Hover over the Mol* viewer to rotate or zoom with the mouse. Move the cursor out of the viewer to go back to normal page scrolling and one-click navigation.
Hover inside the viewer to rotate or zoom. Move out to scroll the page or click links normally.
Color Legend
Unassigned regionsLigand / hetero atomse6rpnA1e6rpnB1
ECOD domains from experimental PDB structures interacting with ligand KL8
UniProtDrugBankPDB LigandPDB IDECOD DomainRange Definition
Q9K2N0n/aKL86rpne6rpnA1A:31-263
Q9K2N0n/aKL86rpne6rpnB1B:31-263