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4UHV

The structure of VgrG1, the needle tip of the bacterial Type VI Secretion System

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsALBA BEAMLINE XALOC
Synchrotron siteALBA
BeamlineXALOC
Temperature [K]100
Detector technologyPIXEL
Collection date2014-07-24
DetectorDECTRIS PILATUS 6M
Spacegroup nameP 63
Unit cell lengths78.620, 78.620, 430.320
Unit cell angles90.00, 90.00, 120.00
Refinement procedure
Resolution71.730 - 2.000
R-factor0.22457
Rwork0.223
R-free0.24845
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)4mtk
RMSD bond length0.010
RMSD bond angle1.662
Data reduction softwareXDS
Data scaling softwareAimless
Phasing softwarePHASER
Refinement softwareREFMAC (5.8.0073)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]86.0601.920
High resolution limit [Å]1.8801.880
Rmerge0.2500.750
Number of reflections111022
<I/σ(I)>61.1
Completeness [%]91.956.1
Redundancy12.54
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
17.2PROTEIN WAS CRYSTALLIZED FROM 0.1 M HEPES PH 7.2, 0.2 M LITHIUM SULPHATE AND 38 % MPD; THEN THE CRYSTAL WAS SOAKED IN 2 MM NEODYMIUM (III) SULFATE

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