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3GSU

Crystal structure of the binary complex between HLA-A2 and HCMV NLV-M5T peptide variant

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsESRF BEAMLINE ID23-2
Synchrotron siteESRF
BeamlineID23-2
Temperature [K]100
Detector technologyCCD
Collection date2008-02-18
DetectorMARMOSAIC 225 mm CCD
Wavelength(s)0.873
Spacegroup nameP 1 21 1
Unit cell lengths54.095, 81.036, 57.728
Unit cell angles90.00, 114.20, 90.00
Refinement procedure
Resolution14.940 - 1.800
R-factor0.206
Rwork0.204
R-free0.24200
Structure solution methodMOLECULAR REPLACEMENT
RMSD bond length0.009
RMSD bond angle1.126
Data reduction softwareXDS
Data scaling softwareXSCALE
Phasing softwareAMoRE
Refinement softwareREFMAC (5.2.0019)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]50.0001.860
High resolution limit [Å]1.8001.800
Rmerge0.0450.380
Number of reflections461473889
<I/σ(I)>18.23.6
Completeness [%]95.487.6
Redundancy3.83.8
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, HANGING DROP6.52939-20% PEG 6000, 0.1M tri-Na Citrate, 0-0.1M NaCl, pH 6.5, vapor diffusion, hanging drop, temperature 293K

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