DrugDomain logoDrugDomain

Attributes

UniProt ID
Protein Name
NAD kinase 1
Ligand Name
2-[6-azanyl-9-[(2R,3R,4S,5R)-5-[[(azanylidene-$l^{4}-azanylidene)amino]methyl]-3,4-bis(oxidanyl)oxolan-2-yl]purin-8-yl]sulfanyl-N-[[(2R,3S,4R,5R)-5-(6-azanyl-8-bromanyl-purin-9-yl)-3,4-bis(oxidanyl)oxolan-2-yl]methyl]ethanamide
DrugBank ID
None
PDB Ligand Accession
ChEMBL ID
n/a
PubChem ID
n/a
InChIKey
WFFKQQMGOXMIGR-ZOUOOXKVSA-N
SMILES
c1nc(c2c(n1)n(c(n2)SCC(=O)NCC3C(C(C(O3)n4c5c(c(ncn5)N)nc4Br)O)O)C6C(C(C(O6)CN=[N+]=[N-])O)O)N
Drug Action
No data available
Affinity Metrics
No affinity data available

3D Structure

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

Structure: 3V8P
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 atomse3v8pA1e3v8pA2
ECOD domains from experimental PDB structures interacting with ligand ZNB
UniProtDrugBankPDB LigandPDB IDECOD DomainRange Definition
Q8Y8D7n/aZNB3v8pe3v8pA1A:96-261
Q8Y8D7n/aZNB3v8pe3v8pA2A:1-95