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3O3Y

A chimeric alpha+alpha/beta peptide based on the CHR domain sequence of gp41

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsAPS BEAMLINE 21-ID-F
Synchrotron siteAPS
Beamline21-ID-F
Temperature [K]100
Detector technologyCCD
Collection date2008-02-05
DetectorMARMOSAIC 225 mm CCD
Wavelength(s)0.97857
Spacegroup nameP 31 2 1
Unit cell lengths33.036, 33.036, 48.900
Unit cell angles90.00, 90.00, 120.00
Refinement procedure
Resolution25.000 - 1.350
R-factor0.14401
Rwork0.143
R-free0.17092
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)3f4z
RMSD bond length0.017
RMSD bond angle1.916
Data reduction softwareHKL-2000
Data scaling softwareHKL-2000
Phasing softwarePHASER
Refinement softwareREFMAC (5.5.0070)
Data quality characteristics
 Overall
Low resolution limit [Å]50.000
High resolution limit [Å]1.350
Number of reflections7108
<I/σ(I)>44.2
Completeness [%]99.3
Redundancy10.4
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, HANGING DROP8.52980.3 M NaCl, 0.1 M Tris pH 8.5, 35% w/v PEG 3350, VAPOR DIFFUSION, HANGING DROP, temperature 298K

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