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6HDL

R49K variant of beta-phosphoglucomutase from Lactococcus lactis complexed with magnesium trifluoride and beta-G6P to 1.2 A.

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsDIAMOND BEAMLINE I03
Synchrotron siteDiamond
BeamlineI03
Temperature [K]100
Detector technologyPIXEL
Collection date2016-12-18
DetectorDECTRIS PILATUS3 6M
Wavelength(s)0.97629
Spacegroup nameP 21 21 21
Unit cell lengths37.550, 54.300, 104.200
Unit cell angles90.00, 90.00, 90.00
Refinement procedure
Resolution35.350 - 1.160
R-factor0.13387
Rwork0.132
R-free0.16356
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)2wf5
RMSD bond length0.011
RMSD bond angle1.506
Data reduction softwarexia2
Data scaling softwarexia2
Phasing softwareMOLREP
Refinement softwareREFMAC (5.8.0230)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]37.5501.180
High resolution limit [Å]1.1601.160
Rmerge0.0681.345
Rmeas0.0731.475
Rpim0.0270.591
Number of reflections734523389
<I/σ(I)>14.2
Completeness [%]98.592.3
Redundancy7.15.9
CC(1/2)0.9990.515
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, HANGING DROP7.229124-34% PEG 4000 200mM sodium acetate 50mM TRIS pH 7.5

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