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4B0N

Crystal structure of PKS-I from the brown algae Ectocarpus siliculosus

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsESRF BEAMLINE ID23-1
Synchrotron siteESRF
BeamlineID23-1
Temperature [K]100
Detector technologyCCD
Collection date2011-02-23
DetectorADSC QUANTUM Q4
Spacegroup nameP 21 21 21
Unit cell lengths61.320, 83.395, 152.729
Unit cell angles90.00, 90.00, 90.00
Refinement procedure
Resolution49.400 - 2.850
R-factor0.21201
Rwork0.211
R-free0.23587
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)1ted
RMSD bond length0.010
RMSD bond angle1.369
Data reduction softwareMOSFLM
Data scaling softwareSCALA
Phasing softwareMOLREP
Refinement softwareREFMAC (5.6.0117)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]49.0003.020
High resolution limit [Å]2.8502.850
Rmerge0.1000.330
Number of reflections18963
<I/σ(I)>8.53.4
Completeness [%]91.777.4
Redundancy4.24.3
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, HANGING DROP82923 MICROLITER DROPS OF PROTEIN AT 7 MG/ML WERE MIXED WITH 1.5 MICROLITERS OF CRYSTALLIZATION BUFFER (0.1 M BICINE PH 8, 18% PEG 6000) USING THE HANGING DROP VAPOR DIFFUSION METHOD AT 19 DEGREES CELSIUS

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