DrugDomain logoDrugDomain

Attributes

UniProt ID
Protein Name
Heat shock protein 83-1
Ligand Name
(4E,6Z,8S,9S,10E,12S,13R,14S,16R)-13-hydroxy-8,14-dimethoxy-4,10,12,16-tetramethyl-3,20,22-trioxo-19-{[2-(pyrrolidin-1-yl)ethyl]amino}-2-azabicyclo[16.3.1]docosa-1(21),4,6,10,18-pentaen-9-yl carbamate
DrugBank ID
None
PDB Ligand Accession
ChEMBL ID
n/a
PubChem ID
n/a
InChIKey
MNMYYWFEPBLDKF-JEVRCCDFSA-N
SMILES
CC1CC(C(C(C=C(C(C(C=CC=C(C(=O)NC2=CC(=O)C(=C(C1)C2=O)NCCN3CCCC3)C)OC)OC(=O)N)C)C)O)OC
Drug Action
No data available
Affinity Metrics
No affinity data available

3D Structure

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

Structure: 3Q5L
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Color Legend
Unassigned regionsLigand / hetero atomse3q5lA1e3q5lB1e3q5lC1e3q5lD1
ECOD domains from experimental PDB structures interacting with ligand KX2
UniProtDrugBankPDB LigandPDB IDECOD DomainRange Definition
Q4Q4I6n/aKX23q5le3q5lA1A:-5-208
Q4Q4I6n/aKX23q5le3q5lB1B:-5-208
Q4Q4I6n/aKX23q5le3q5lC1C:-7-208
Q4Q4I6n/aKX23q5le3q5lD1D:-6-208