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Attributes

UniProt ID
Protein Name
Endoplasmic reticulum chaperone BiP
Ligand Name
4-[[(2R,3S,4R,5R)-5-[6-amino-8-[(3,4-dichlorophenyl)methylamino]purin-9-yl]-3,4-dihydroxy-oxolan-2-yl]methoxymethyl]benzonitrile
DrugBank ID
None
PDB Ligand Accession
ChEMBL ID
n/a
PubChem ID
n/a
InChIKey
ZXGGCBQORXDVTE-UMCMBGNQSA-N
SMILES
c1cc(ccc1COCC2C(C(C(O2)n3c4c(c(ncn4)N)nc3NCc5ccc(c(c5)Cl)Cl)O)O)C#N
Drug Action
No data available
Affinity Metrics
No affinity data available

3D Structure

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

Structure: 6CZ1
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Color Legend
Unassigned regionsLigand / hetero atomse6cz1A1e6cz1A2e6cz1B1e6cz1B2
ECOD domains from experimental PDB structures interacting with ligand 3FD
UniProtDrugBankPDB LigandPDB IDECOD DomainRange Definition
P11021n/a3FD6cz1e6cz1A1A:215-407
P11021n/a3FD6cz1e6cz1A2A:26-214
P11021n/a3FD6cz1e6cz1B1B:215-407
P11021n/a3FD6cz1e6cz1B2B:27-214