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7X0C

Crystal structure of phospholipase A1, AtDSEL

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsPHOTON FACTORY BEAMLINE BL-17A
Synchrotron sitePhoton Factory
BeamlineBL-17A
Temperature [K]93
Detector technologyPIXEL
Collection date2012-06-25
DetectorDECTRIS EIGER X 16M
Wavelength(s)1.0082
Spacegroup nameP 1 21 1
Unit cell lengths73.977, 95.343, 79.278
Unit cell angles90.00, 105.14, 90.00
Refinement procedure
Resolution33.287 - 1.799
R-factor0.179912963409
Rwork0.178
R-free0.21173
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)2yij
RMSD bond length0.012
RMSD bond angle1.127
Refinement softwarePHENIX (1.10.1_2155)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]50.0001.860
High resolution limit [Å]1.7991.800
Rmerge0.0860.400
Number of reflections1058924586
<I/σ(I)>35.294.7
Completeness [%]99.8
Redundancy7.5
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, SITTING DROP2930.02M calcium chloride, 0.1M sodium acetate, 30% MPD

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