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3ZC7

VbhT Fic protein from Bartonella schoenbuchensis in complex with VbhA antitoxin and ATP

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsSLS BEAMLINE X06DA
Synchrotron siteSLS
BeamlineX06DA
Temperature [K]100
Detector technologyCCD
Collection date2011-02-21
DetectorMARMOSAIC 225 mm CCD
Spacegroup nameC 1 2 1
Unit cell lengths106.460, 40.620, 73.740
Unit cell angles90.00, 121.55, 90.00
Refinement procedure
Resolution15.000 - 2.100
R-factor0.1679
Rwork0.165
R-free0.23190
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)3shg
RMSD bond length0.007
RMSD bond angle1.008
Data reduction softwareXDS
Data scaling softwareXDS
Phasing softwarePHASER
Refinement softwarePHENIX ((PHENIX.REFINE))
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]45.3602.200
High resolution limit [Å]2.1002.100
Rmerge0.0800.340
Number of reflections15824
<I/σ(I)>18.875.86
Completeness [%]98.893.6
Redundancy5.44.89
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
16.515% PEG 4000, 0.1M MES PH 6.5. THEN SOAKED WITH 5MM ATP AND 5MM MGCL2U.

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