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4ALF

Pseudomonas fluorescens PhoX in complex with phosphate

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsDIAMOND BEAMLINE I03
Synchrotron siteDiamond
BeamlineI03
Temperature [K]120
Detector technologyPIXEL
Collection date2012-02-18
DetectorDECTRIS PILATUS 6M
Spacegroup nameP 21 21 21
Unit cell lengths69.099, 71.035, 228.501
Unit cell angles90.00, 90.00, 90.00
Refinement procedure
Resolution16.140 - 1.250
R-factor0.1343
Rwork0.133
R-free0.16432
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)3zwu
RMSD bond length0.009
RMSD bond angle1.463
Data reduction softwareXDS
Data scaling softwareAimless
Phasing softwarePHASER
Refinement softwareREFMAC (5.6.0117)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]16.2001.310
High resolution limit [Å]1.2501.250
Rmerge0.0700.400
Number of reflections258332
<I/σ(I)>6.32.2
Completeness [%]83.674.3
Redundancy2.52.6
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
180.1 M TRIS HCL PH 8.0, 0.2 M LICL, REMARK 280 20% W/V PEG 6000. THE CRYSTALS WERE SOAKED WITH 100 UL PHOSPHATE BUFFERED SALINE FOR HALF AN HOUR

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