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4NAI

Arabidopsis thaliana IspD apo

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsSLS BEAMLINE X06SA
Synchrotron siteSLS
BeamlineX06SA
Temperature [K]100
Detector technologyPIXEL
Collection date2012-06-23
DetectorPSI PILATUS 6M
Spacegroup nameH 3 2
Unit cell lengths73.640, 73.640, 224.390
Unit cell angles90.00, 90.00, 120.00
Refinement procedure
Resolution10.000 - 1.500
R-factor0.178
Rwork0.177
R-free0.19400
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)1w77
RMSD bond length0.027
RMSD bond angle2.663
Data reduction softwareXDS
Data scaling softwareXDS
Phasing softwarePHASER
Refinement softwareREFMAC (5.6.0117)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]30.0001.600
High resolution limit [Å]1.5001.500
Rmerge0.0390.567
Number of reflections37739
<I/σ(I)>233.8
Completeness [%]99.799.9
Redundancy5.3
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
17.529350 mM HEPES, 50 mM CdSO4, 800 mM KAc, pH 7.5, VAPOR DIFFUSION, HANGING DROP, temperature 293K

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