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4N1Y

Crystal Structure of the Pacific Oyster Estrogen Receptor Ligand Binding Domain

Replaces:  3LTX
Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsAPS BEAMLINE 22-ID
Synchrotron siteAPS
Beamline22-ID
Temperature [K]100
Detector technologyCCD
Collection date2008-02-08
DetectorMARMOSAIC 300 mm CCD
Wavelength(s)1.0
Spacegroup nameP 21 21 21
Unit cell lengths55.035, 105.795, 171.503
Unit cell angles90.00, 90.00, 90.00
Refinement procedure
Resolution46.958 - 2.605
R-factor0.1738
Rwork0.170
R-free0.24270
Structure solution methodMOLECULAR REPLACEMENT
RMSD bond length0.009
RMSD bond angle1.301
Data reduction softwareDENZO
Data scaling softwareSCALEPACK
Phasing softwarePHASER
Refinement softwarePHENIX (dev_1458)
Data quality characteristics
 OverallInner shellOuter shell
Low resolution limit [Å]50.00050.0002.690
High resolution limit [Å]2.6005.6002.600
Rmerge0.1400.0970.416
Number of reflections28364
<I/σ(I)>11
Completeness [%]90.199.964.1
Redundancy7.37.95.2
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, HANGING DROP829325% PEG 4K, 10% glycerol, 0.1M Tris-HCl, pH 8, VAPOR DIFFUSION, HANGING DROP, temperature 293K

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