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5UGR

Malyl-CoA lyase from Methylobacterium extorquens

Replaces:  4ROQ
Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsSSRL BEAMLINE BL7-1
Synchrotron siteSSRL
BeamlineBL7-1
Temperature [K]100
Detector technologyCCD
Collection date2014-07-10
DetectorADSC QUANTUM 315r
Wavelength(s)1.127092
Spacegroup nameP 6 2 2
Unit cell lengths126.524, 126.524, 103.207
Unit cell angles90.00, 90.00, 120.00
Refinement procedure
Resolution38.440 - 1.560
R-factor0.10375
Rwork0.102
R-free0.13422
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)4l9z
RMSD bond length0.017
RMSD bond angle1.840
Data reduction softwareXDS
Data scaling softwareAimless
Phasing softwarePHASER
Refinement softwareREFMAC (5.8.0135)
Data quality characteristics
 OverallInner shellOuter shell
Low resolution limit [Å]38.44038.4401.590
High resolution limit [Å]1.5608.5501.560
Rmerge0.0600.0310.522
Number of reflections62486
<I/σ(I)>22.2622.7
Completeness [%]91.180.279.3
Redundancy11.111.45.9
CC(1/2)0.9990.9980.845
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, SITTING DROP7.52980.1 M Hepes, pH 7.5, 30 % w/v PEG 400, 0.2 M MgCl2

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