Loading
PDBj
MenuPDBj@FacebookPDBj@TwitterPDBj@YouTubewwPDB FoundationwwPDB
RCSB PDBPDBeBMRBAdv. SearchSearch help

4NY9

Crystal Structure Of the Human PXR-LBD In Complex With N-{(2R)-1-[(4S)-4-(4-chlorophenyl)-4-hydroxy-3,3-dimethylpiperidin-1-yl]-3-methyl-1-oxobutan-2-yl}-3-hydroxy-3-methylbutanamide

Summary for 4NY9
Entry DOI10.2210/pdb4ny9/pdb
DescriptorNuclear receptor subfamily 1 group I member 2, N-{(2R)-1-[(4S)-4-(4-chlorophenyl)-4-hydroxy-3,3-dimethylpiperidin-1-yl]-3-methyl-1-oxobutan-2-yl}-3-hydroxy-3-methylbutanamide, GLYCEROL, ... (4 entities in total)
Functional Keywordspregnane x receptor, pxr, ligand binding domain, steroid receptor coactivator-1; ccr1, chemokine receptor-1; nr, nuclear receptor; af, activation function; mdr1, multi-drug resistance gene-1, transcription-transcription inhibitor complex, transcription/transcription inhibitor
Biological sourceHomo sapiens (human)
Cellular locationNucleus : O75469
Total number of polymer chains1
Total formula weight33978.83
Authors
Khan, J.A.,Camac, D.M. (deposition date: 2013-12-10, release date: 2014-08-27, Last modification date: 2024-02-28)
Primary citationSantella, J.B.,Gardner, D.S.,Duncia, J.V.,Wu, H.,Dhar, M.,Cavallaro, C.,Tebben, A.J.,Carter, P.H.,Barrish, J.C.,Yarde, M.,Briceno, S.W.,Cvijic, M.E.,Grafstrom, R.R.,Liu, R.,Patel, S.R.,Watson, A.J.,Yang, G.,Rose, A.V.,Vickery, R.D.,Caceres-Cortes, J.,Caporuscio, C.,Camac, D.M.,Khan, J.A.,An, Y.,Foster, W.R.,Davies, P.,Hynes, J.
Discovery of the CCR1 antagonist, BMS-817399, for the treatment of rheumatoid arthritis.
J.Med.Chem., 57:7550-7564, 2014
Cited by
PubMed: 25101488
DOI: 10.1021/jm5003167
PDB entries with the same primary citation
Experimental method
X-RAY DIFFRACTION (2.8 Å)
Structure validation

217705

数据于2024-03-27公开中

PDB statisticsPDBj update infoContact PDBjnumon