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4CP2

Crystal Structure of Epithelial Adhesin 9 A domain (Epa9A) from Candida glabrata in complex with Galb1-4GlcNAc

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsBESSY BEAMLINE 14.1
Synchrotron siteBESSY
Beamline14.1
Temperature [K]100
Detector technologyPIXEL
Collection date2013-02-13
DetectorDECTRIS PILATUS 6M
Spacegroup nameP 31 2 1
Unit cell lengths66.840, 66.840, 115.950
Unit cell angles90.00, 90.00, 120.00
Refinement procedure
Resolution41.000 - 2.600
R-factor0.18392
Rwork0.181
R-free0.24228
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)PRUNED VERSION OF PDB ENTRY 4AF9
RMSD bond length0.008
RMSD bond angle1.312
Data reduction softwareXDS
Data scaling softwareXSCALE
Phasing softwarePHASER
Refinement softwareREFMAC (5.7.0032)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]40.9602.720
High resolution limit [Å]2.5802.580
Rmerge0.1200.580
Number of reflections9889
<I/σ(I)>15.73.7
Completeness [%]99.9100
Redundancy8.18
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, SITTING DROP0.1 M MAGNESIUM CHLORIDE, 0.1M SODIUM CHLORIDE, 0.1 M MES PH6.5, 12% PEG 4000, 0.05 M LACTOSE, VAPOR DIFFUSION IN SITTING DROP, SOAKED WITH GALB1-4GLCNAC

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