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3PIU

High-resolution structure of native Malus domestica ACC synthase

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsESRF BEAMLINE BM1A
Synchrotron siteESRF
BeamlineBM1A
Temperature [K]100
Detector technologyIMAGE PLATE
Collection date2001-09-19
DetectorMAR scanner 345 mm plate
Spacegroup nameC 1 2 1
Unit cell lengths103.710, 61.140, 76.830
Unit cell angles90.00, 123.12, 90.00
Refinement procedure
Resolution29.300 - 1.350
R-factor0.149
Rwork0.149
R-free0.17100
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)1m7y
RMSD bond length0.005
RMSD bond angle1.017
Data reduction softwareXDS
Data scaling softwareXSCALE
Phasing softwarePHASER (2.1.4)
Refinement softwarePHENIX (1.6.1_357)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]29.3001.400
High resolution limit [Å]1.3501.350
Number of reflections87561
<I/σ(I)>16.952
Completeness [%]98.999.7
Redundancy3.8
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
129327% MPD (v/v) and 50 mM MES, pH 6.5, VAPOR DIFFUSION, SITTING DROP, temperature 293K

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