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3NC3

CYP134A1 structure with a closed substrate binding loop

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsSLS BEAMLINE X10SA
Synchrotron siteSLS
BeamlineX10SA
Temperature [K]100
Detector technologyCCD
Collection date2009-12-11
DetectorMARMOSAIC 225 mm CCD
Wavelength(s)0.9790
Spacegroup nameP 21 21 21
Unit cell lengths63.800, 105.400, 143.900
Unit cell angles90.00, 90.00, 90.00
Refinement procedure
Resolution47.740 - 2.660
R-factor0.22147
Rwork0.219
R-free0.27343
Structure solution methodSAD
RMSD bond length0.010
RMSD bond angle1.327
Data reduction softwareXDS
Data scaling softwareXDS
Phasing softwareSHARP
Refinement softwareREFMAC (5.5.0070)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]47.7302.730
High resolution limit [Å]2.6602.660
Rmerge0.1400.580
Number of reflections21929
<I/σ(I)>8.32.1
Completeness [%]91.380.8
Redundancy3.9
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, HANGING DROP6.52930.1 M Bis-Tris, 0.1 M MgCl2, 12% (w/v) polyethylene glycol-3350, pH 6.5, VAPOR DIFFUSION, HANGING DROP, temperature 293K

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