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2YVU

Crystal structure of APE1195

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsSPRING-8 BEAMLINE BL26B2
Synchrotron siteSPring-8
BeamlineBL26B2
Temperature [K]100
Detector technologyCCD
Collection date2007-03-28
DetectorRIGAKU JUPITER 210
Wavelength(s)1.00000
Spacegroup nameP 1 21 1
Unit cell lengths44.010, 102.820, 45.580
Unit cell angles90.00, 96.67, 90.00
Refinement procedure
Resolution45.270 - 2.100
R-factor0.202
Rwork0.202
R-free0.24900
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)2gks
RMSD bond length0.009
RMSD bond angle1.400
Data reduction softwareHKL-2000
Data scaling softwareSCALEPACK
Phasing softwareMOLREP
Refinement softwareCNS (1.2)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]50.0002.180
High resolution limit [Å]2.1002.100
Rmerge0.0450.159
Number of reflections23213
<I/σ(I)>31.25.4
Completeness [%]98.891.3
Redundancy5.34.4
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1oil batch7.629315% (v/v) MPD, 0.1M HEPES-NaOH, 0.2M tri-Na Citr, pH 7.6, oil batch, temperature 293K

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