Brand  (β version)

PDB ID: 1XNN

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Ligands
Code Name Style Show Link
HYQ Rel-(3ar,4s,7r,7as)-3a,4,7,7a-tetrahydro-2-(4-nitro-1-naphthalenyl)-4,7-ethano-1h-isoindole-1,3(2h)-dione PoSSuM
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Structure summary

Code : 1XNN   PDBj   RCSB PDB   PDBe
Header : HORMONE/GROWTH FACTOR
Title : CRYSTAL STRUCTURE OF THE RAT ANDROGEN RECEPTOR LIGAND BINDING DOMAIN T877A MUTANT COMPLEX WITH (3A-ALPHA-,4-ALPHA 7-ALPHA-,7A-ALPHA-)-3A,4,7,7A-TETRAHYDRO-2-(4-NITRO-1-NAPHTHALENYL)-4,7-ETHANO-1H-ISOINDOLE-1,3(2H)-DIONE.
Release Data : 2005-10-11
Compound :
mol_id molecule chains synonym
1 Androgen receptor A Dihydrotestosterone receptor
fragment: LIGAND-BINDING DOMAIN
mutation: T877A
Source :
mol_id organism_scientific organism_common expression_system
1 Rattus norvegicus  (taxid:10116) Norway rat Escherichia coli BL21(DE3)  (taxid:469008)
gene: Ar, Nr3c4
expression_system_strain: BL21-DE3
expression_system_vector_type: PLASMID
expression_system_plasmid: PET28B
Authors : Sack, J.
Keywords : ANDROGEN RECEPTOR, STEROID RECEPTOR, NUCLEAR RECEPTOR, TRANSCRIPTION REGULATION, LIGAND-BINDING DOMAIN, HORMONE-GROWTH FACTOR COMPLEX
Exp. method : X-RAY DIFFRACTION ( 2.20 Å )
Citation :

Structure based approach to the design of bicyclic-1H-isoindole-1,3(2H)-dione based androgen receptor antagonists.

Salvati, M.E.,Balog, A.,Shan, W.  et al.
(2005)  Bioorg.Med.Chem.Lett.  15 : 271 - 276

PubMed: 15603938
DOI: 10.1016/j.bmcl.2004.10.085

Reaction

Chain : A
UniProt : P15207 (ANDR_RAT)
Reaction : -