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3UJ7

Phosphoethanolamine methyltransferase from Plasmodium falciparum in complex with SAM and PO4

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsAPS BEAMLINE 19-ID
Synchrotron siteAPS
Beamline19-ID
Temperature [K]100
Detector technologyCCD
Collection date2010-11-22
DetectorADSC QUANTUM 315r
Wavelength(s)0.979
Spacegroup nameP 1 2 1
Unit cell lengths77.035, 44.130, 88.411
Unit cell angles90.00, 108.48, 90.00
Refinement procedure
Resolution37.774 - 1.549
R-factor0.1674
Rwork0.167
R-free0.18460
Structure solution methodMOLECULAR REPLACEMENT
RMSD bond length0.006
RMSD bond angle1.030
Data reduction softwareHKL-3000
Data scaling softwareHKL-3000
Phasing softwarePHASER
Refinement softwarePHENIX ((phenix.refine: 1.6.2_432))
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]37.8001.600
High resolution limit [Å]1.5491.550
Number of reflections74087
<I/σ(I)>18.11.8
Completeness [%]99.199.1
Redundancy3.1
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, HANGING DROP6.527720% PEG-8000, 0.1 M sodium cacodylate, pH 6.5, 0.2 M sodium acetate, 5 mM 2-mercaptoethanol, VAPOR DIFFUSION, HANGING DROP, temperature 277K

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