DrugDomain logoDrugDomain

Attributes

UniProt ID
Protein Name
Integrase
Ligand Name
(4R,12aS)-N-(2,4-difluorobenzyl)-7-hydroxy-4-methyl-6,8-dioxo-3,4,6,8,12,12a-hexahydro-2H-pyrido[1',2':4,5]pyrazino[2,1-b][1,3]oxazine-9-carboxamide
DrugBank ID
PDB Ligand Accession
ChEMBL ID
n/a
PubChem ID
n/a
InChIKey
RHWKPHLQXYSBKR-BMIGLBTASA-N
SMILES
CC1CCOC2N1C(=O)C3=C(C(=O)C(=CN3C2)C(=O)NCc4ccc(cc4F)F)O
Drug Action
No data available
Affinity Metrics
No affinity data available

3D Structure

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

Structure: 6VDK
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 atomse6vdkA1e6vdkA2e6vdkA3e6vdkB1e6vdkB2e6vdkB3e6vdkC1e6vdkC2e6vdkC3e6vdkD1e6vdkD2e6vdkD3e6vdkI1e6vdkJ1e6vdkM1e6vdkP1
ECOD domains from experimental PDB structures interacting with ligand DB08930
UniProtDrugBankPDB LigandPDB IDECOD DomainRange Definition
F2WR39DB08930DLU6vdke6vdkA1A:49-213
F2WR39DB08930DLU6vdke6vdkC2C:49-213
F2WR39DB08930DLU6vdke6vdkM1M:222-270
F2WR39DB08930DLU6vdke6vdkP1P:222-268