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2UY6

Crystal structure of the P pilus rod subunit PapA

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsESRF BEAMLINE ID29
Synchrotron siteESRF
BeamlineID29
Temperature [K]100
Detector technologyCCD
Collection date2006-07-21
DetectorADSC CCD
Spacegroup nameC 1 2 1
Unit cell lengths133.100, 73.560, 80.480
Unit cell angles90.00, 108.84, 90.00
Refinement procedure
Resolution76.300 - 2.500
R-factor0.2219
Rwork0.222
R-free0.26160
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)1pdk
RMSD bond length0.006
RMSD bond angle1.308
Data reduction softwareMOSFLM
Data scaling softwareSCALA
Phasing softwareAMoRE
Refinement softwareCNS (1.1)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]76.3002.640
High resolution limit [Å]2.5002.500
Rmerge0.0900.380
Number of reflections25542
<I/σ(I)>6.21.9
Completeness [%]100.099.5
Redundancy6.87
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
17.5PEG8K 12%, 5% ISOPROPANOL, TRIS 0.1M PH 7.5

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