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5FX8

Complete structure of manganese lipoxygenase of Gaeumannomyces graminis and partial structure of zonadhesin of Komagataella pastoris

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsESRF BEAMLINE ID29
Synchrotron siteESRF
BeamlineID29
Temperature [K]100
Detector technologyPIXEL
Collection date2013-07-29
DetectorDECTRIS PILATUS 6M
Spacegroup nameC 1 2 1
Unit cell lengths226.309, 50.470, 177.622
Unit cell angles90.00, 91.28, 90.00
Refinement procedure
Resolution43.163 - 2.600
R-factor0.1977
Rwork0.195
R-free0.24460
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)5fno
RMSD bond length0.013
RMSD bond angle1.152
Data reduction softwareXDS
Data scaling softwareSCALA
Phasing softwarePHENIX
Refinement softwarePHENIX ((PHENIX.REFINE))
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]49.4002.800
High resolution limit [Å]2.6002.600
Rmerge0.1000.750
Number of reflections62790
<I/σ(I)>7.63
Completeness [%]97.899
Redundancy2.93
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
10.1M MES-IMIDAZOLE PH6.5, 20%(V/V) GLYCEROL, 10%(W/V)PEG4000, 0.03M MAGNESIUM CHLORIDE, 0.03M CALCIUM CHLORIDE

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