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5GTR

estrogen receptor alpha in complex with a stabilized peptide antagonist 6

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeROTATING ANODE
Source detailsRIGAKU MICROMAX-007 HF
Temperature [K]100
Detector technologyPIXEL
Collection date2015-11-10
DetectorDECTRIS PILATUS 300K
Wavelength(s)1.5418
Spacegroup nameP 2 21 21
Unit cell lengths54.787, 60.219, 66.457
Unit cell angles90.00, 90.00, 90.00
Refinement procedure
Resolution19.438 - 2.804
R-factor0.2281
Rwork0.221
R-free0.36740
Structure solution methodMOLECULAR REPLACEMENT
RMSD bond length0.011
RMSD bond angle1.328
Data reduction softwareHKL-3000
Data scaling softwareHKL-3000
Phasing softwarePHENIX
Refinement softwarePHENIX ((1.10.1_2155: ???))
Data quality characteristics
 Overall
Low resolution limit [Å]20.000
High resolution limit [Å]2.800
Number of reflections5526
<I/σ(I)>13
Completeness [%]95.5
Redundancy4.3
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, SITTING DROP6.52930.2 M Magnesium acetate tetrahydrate, 0.1 M Sodium cacodylate trihydrate, 20% w/v Polyethylene glycol 8000

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