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3VUS

Escherichia coli PgaB N-terminal domain

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsPHOTON FACTORY BEAMLINE BL-17A
Synchrotron sitePhoton Factory
BeamlineBL-17A
Temperature [K]93
Detector technologyCCD
Collection date2011-07-05
DetectorADSC QUANTUM 315r
Wavelength(s)1.00000
Spacegroup nameP 1 21 1
Unit cell lengths39.559, 53.114, 144.170
Unit cell angles90.00, 95.25, 90.00
Refinement procedure
Resolution25.000 - 1.650
R-factor0.20587
Rwork0.205
R-free0.25633
Structure solution methodMIRAS
RMSD bond length0.027
RMSD bond angle2.294
Data reduction softwareHKL-2000
Data scaling softwareSCALEPACK
Phasing softwareSOLVE
Refinement softwareREFMAC (5.6.0119)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]50.0001.680
High resolution limit [Å]1.6501.650
Rmerge0.0490.375
Number of reflections69364
Completeness [%]96.783.7
Redundancy4.94.3
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, HANGING DROP6.52930.18M Sodium acetate, 0.1M Bis-Tris, 16%(w/v) PEG3350, pH6.5, VAPOR DIFFUSION, HANGING DROP, temperature 293K
1VAPOR DIFFUSION, HANGING DROP6.52930.18M Sodium acetate, 0.1M Bis-Tris, 16%(w/v) PEG3350, pH6.5, VAPOR DIFFUSION, HANGING DROP, temperature 293K

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