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6GOA

Structural basis for OXA-48 dimerization - R189A mutant

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsBESSY BEAMLINE 14.1
Synchrotron siteBESSY
Beamline14.1
Temperature [K]100
Detector technologyPIXEL
Collection date2018-02-27
DetectorDECTRIS PILATUS 6M
Wavelength(s)0.9184109
Spacegroup nameP 1 21 1
Unit cell lengths107.726, 85.545, 125.805
Unit cell angles90.00, 90.08, 90.00
Refinement procedure
Resolution24.670 - 2.550
R-factor0.2406
Rwork0.239
R-free0.27480
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)5qb0
RMSD bond length0.003
RMSD bond angle0.571
Data reduction softwareXDS (20180126)
Data scaling softwareAimless (0.5.31)
Phasing softwarePHASER (2.8)
Refinement softwarePHENIX (dev_3150)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]24.6702.641
High resolution limit [Å]2.5502.550
Rmeas0.206
Number of reflections72154
<I/σ(I)>51.09
Completeness [%]96.296.56
Redundancy1.91.9
CC(1/2)0.9820.568
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, HANGING DROP2980.1 M BIS-Tris-propane pH 9.5, 16% PEG MME 5000

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