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6G26

The crystal structure of the Burkholderia pseudomallei HicAB complex

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsDIAMOND BEAMLINE I04
Synchrotron siteDiamond
BeamlineI04
Temperature [K]80
Detector technologyPIXEL
Collection date2016-09-18
DetectorDECTRIS PILATUS 6M-F
Wavelength(s)0.9795
Spacegroup nameP 1 21 1
Unit cell lengths85.140, 74.190, 85.310
Unit cell angles90.00, 90.05, 90.00
Refinement procedure
Resolution34.020 - 2.490
R-factor0.18905
Rwork0.187
R-free0.23254
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)6g1n
RMSD bond length0.013
RMSD bond angle1.739
Data reduction softwareXDS
Data scaling softwarexia2
Phasing softwareMOLREP
Refinement softwareREFMAC (5.8.0189)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]38.1502.530
High resolution limit [Å]2.4902.490
Rmerge0.1111.246
Rmeas0.1201.349
Number of reflections35696
<I/σ(I)>14.1
Completeness [%]99.999.8
Redundancy6.86.8
CC(1/2)0.9970.655
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, HANGING DROP6.52890.1 M MES pH 6.5 0.2 M NH4S04 16% (w/v) PEG 5000 MME 25% (v/v) glycerol

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