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5UAX

Structure of apo human PYCR-1 crystallized in space group C2

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsALS BEAMLINE 4.2.2
Synchrotron siteALS
Beamline4.2.2
Temperature [K]100
Detector technologyCMOS
Collection date2015-10-18
DetectorRDI CMOS_8M
Wavelength(s)1.00
Spacegroup nameC 1 2 1
Unit cell lengths183.850, 120.690, 88.140
Unit cell angles90.00, 109.25, 90.00
Refinement procedure
Resolution60.345 - 1.850
R-factor0.1738
Rwork0.172
R-free0.19960
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)2izz
RMSD bond length0.014
RMSD bond angle1.273
Data reduction softwareXDS
Data scaling softwareAimless (0.5.15)
Phasing softwarePHASER
Refinement softwarePHENIX ((1.10.1_2155))
Data quality characteristics
 OverallInner shellOuter shell
Low resolution limit [Å]60.34560.3401.880
High resolution limit [Å]1.85010.1301.850
Rmerge0.0550.0280.672
Number of reflections153414
<I/σ(I)>16.1
Completeness [%]99.396.895.9
Redundancy4.46.32.9
CC(1/2)0.9990.9990.688
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, SITTING DROP2953 M NaCl and 0.1 M HEPES at pH 7.5-8.0

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