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2EGI

Crystal Structure of a Hypothetical Protein(AQ1494) from Aquifex aeolicus

Experimental procedure
Experimental methodMAD
Source typeSYNCHROTRON
Source detailsSPRING-8 BEAMLINE BL26B2
Synchrotron siteSPring-8
BeamlineBL26B2
Temperature [K]180
Detector technologyCCD
Collection date2006-11-13
DetectorRIGAKU JUPITER 210
Wavelength(s)0.97884,0.9000,0.97973
Spacegroup nameP 21 21 2
Unit cell lengths98.493, 97.754, 113.194
Unit cell angles90.00, 90.00, 90.00
Refinement procedure
Resolution19.720 - 2.300
R-factor0.24
Rwork0.240
R-free0.28200
Structure solution methodMAD
RMSD bond length0.007
RMSD bond angle1.200
Data reduction softwareHKL-2000
Data scaling softwareHKL-2000
Phasing softwareMOLREP
Refinement softwareCNS (1.1)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]40.0002.070
High resolution limit [Å]2.0002.000
Rmerge0.0850.416
Number of reflections74399
Completeness [%]99.698.8
Redundancy6.85.7
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1MICROBATCH7.529320% PEG8000, 0.1M HEPES pH7.5, micro batch, temperature 293K

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