3E7C

Glucocorticoid Receptor LBD bound to GSK866

Summary for 3E7C

• Entry DOI: 10.2210/pdb3e7c/pdb
• Related: 1m2z
• Descriptor: Glucocorticoid receptor, Nuclear receptor coactivator 2, 5-amino-N-[(2S)-2-({[(2,6-dichlorophenyl)carbonyl](ethyl)amino}methyl)-3,3,3-trifluoro-2-hydroxypropyl]-1-(4-fluorophenyl)-1H-pyrazole-4-carboxamide, ... (5 entities in total)
• Functional Keywords: gr, glucocorticoid receptor, nuclear receptor, alternative initiation, chromatin regulator, disease mutation, dna-binding, lipid-binding, metal-binding, nucleus, phosphoprotein, pseudohermaphroditism, receptor, steroid-binding, transcription, transcription regulation, zinc-finger, activator
• Biological source: Homo sapiens (Human); More
• Cellular location: Isoform Alpha: Cytoplasm . Isoform Beta: Nucleus . Isoform Alpha-B: Nucleus : P04150; Nucleus: Q15596
• Total number of polymer chains: 4
• Total formula weight: 63783.55

Authors

Madauss, K.P.,Williams, S.P.,Mclay, I.,Stewart, E.L.,Bledsoe, R.K. (deposition date: 2008-08-18, release date: 2008-11-25, Last modification date: 2024-04-03)

Primary citation

Madauss, K.P.,Bledsoe, R.K.,Mclay, I.,Stewart, E.L.,Uings, I.J.,Weingarten, G.,Williams, S.P.
The first X-ray crystal structure of the glucocorticoid receptor bound to a non-steroidal agonist.
Bioorg.Med.Chem.Lett., 18:6097-6099, 2008

PubMed Abstract: The amino-pyrazole 2,6-dichloro-N-ethyl benzamide 1 is a selective GR agonist with dexamethasone-like in vitro potency. Its X-ray crystal structure in the GR LBD (Glucocorticoid ligand-binding domain) is described and compared to other reported structures of steroidal GR agonists in the GR LBD (3E7C).

PubMed: 18952422
DOI: 10.1016/j.bmcl.2008.10.021

Experimental method

X-RAY DIFFRACTION (2.15 Å)