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Attributes

UniProt ID
Protein Name
Heat shock protein HSP 90-alpha
Ligand Name
4-(2,4-dichloro-5-methoxyphenyl)-2,6-dimethyl-7H-pyrrolo[2,3-d]pyrimidine-5-carbonitrile
DrugBank ID
None
PDB Ligand Accession
ChEMBL ID
n/a
PubChem ID
n/a
InChIKey
MCTFCIHBXQNCGL-UHFFFAOYSA-N
SMILES
Cc1c(c2c(nc(nc2[nH]1)C)c3cc(c(cc3Cl)Cl)OC)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: 3RLR
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Color Legend
Unassigned regionsLigand / hetero atomse3rlrA1e3rlrB1
ECOD domains from experimental PDB structures interacting with ligand 3RR
UniProtDrugBankPDB LigandPDB IDECOD DomainRange Definition
P07900n/a3RR3rlre3rlrA1A:9-227
P07900n/a3RR3rlre3rlrB1B:9-229