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Ligands
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JJ3 (3as,4r,9br)-4-(4-hydroxyphenyl)-6-(methoxymethyl)-1,2,3,3a,4,9b-hexahydrocyclopenta[C]chromen-8-ol
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Code : 2QE4   PDBj   RCSB PDB   PDBe
Header : TRANSCRIPTION
Title : Estrogen receptor alpha ligand-binding domain in complex with a benzopyran agonist
Release Data : 2007-09-04
Compound :
mol_id molecule chains synonym
1 Estrogen receptor A,B ER, Estradiol receptor, ER-alpha
fragment: Ligand binding domain
mutation: C381S, C417S, C530S
Source :
mol_id organism_scientific organism_common expression_system
1 Homo sapiens  (taxid:9606) Human Escherichia coli BL21(DE3)  (taxid:469008)
gene: ESR1, ESR, NR3A1
expression_system_strain: BL21(DE3)
expression_system_vector_type: Plasmid
Authors : Norman, B.H., Richardson, T.I., Dodge, J.A., Pfeifer, L.A., Durst, G.L., Wang, Y., Durbin, J.D., Krishnan, V., Dinn, S.R., Liu, S.Q., Reilly, J.E., Ryter, K.T.
Keywords : nuclear receptor, ligand-binding domain, Alternative splicing, DNA-binding, Lipid-binding, Metal-binding, Nuclear protein, Phosphorylation, Polymorphism, Steroid-binding, Transcription, Transcription regulation, Zinc, Zinc-finger
Exp. method : X-RAY DIFFRACTION ( 2.40 Å )
Citation :

Benzopyrans as selective estrogen receptor beta agonists (SERBAs). Part 4: Functionalization of the benzopyran A-ring.

Norman, B.H.,Richardson, T.I.,Dodge, J.A.  et al.
(2007)  Bioorg.Med.Chem.Lett.  17 : 5082 - 5085

PubMed: 17662603
DOI: 10.1016/j.bmcl.2007.07.009

Chain : A, B
UniProt : P03372 (ESR1_HUMAN)
Reaction : -