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3AGI

High resolution X-ray analysis of Arg-lysozyme complex in the presence of 500 mM Arg

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsSPRING-8 BEAMLINE BL38B1
Synchrotron siteSPring-8
BeamlineBL38B1
Temperature [K]100
Detector technologyCCD
Collection date2010-02-17
DetectorADSC QUANTUM 210
Wavelength(s)1.000
Spacegroup nameP 43 21 2
Unit cell lengths78.033, 78.033, 37.752
Unit cell angles90.00, 90.00, 90.00
Refinement procedure
Resolution39.020 - 1.200
R-factor0.13866
Rwork0.137
R-free0.16664
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)3a34
RMSD bond length0.017
RMSD bond angle1.790
Data reduction softwareHKL-2000
Data scaling softwareHKL-2000
Phasing softwareMOLREP
Refinement softwareREFMAC (5.2.0019)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]50.0001.240
High resolution limit [Å]1.2001.200
Rmerge0.0520.460
Number of reflections34994
<I/σ(I)>4.3
Completeness [%]100
Redundancy14.714.4
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION4.52930.05 M Sodium Acetate 1.6 M Sodium Chloride 0.5 M Arg, pH 4.5, VAPOR DIFFUSION, temperature 293K

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