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5Y5G

Structure of cytochrome P450nor in NO-bound state: damaged by high-dose (5.7 MGy) X-ray

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsSPRING-8 BEAMLINE BL26B1
Synchrotron siteSPring-8
BeamlineBL26B1
Temperature [K]100
Detector technologyCCD
Collection date2015-05-18
DetectorRAYONIX MX-225
Wavelength(s)1.00
Spacegroup nameP 21 21 21
Unit cell lengths55.189, 75.477, 101.668
Unit cell angles90.00, 90.00, 90.00
Refinement procedure
Resolution26.972 - 1.360
R-factor0.1349
Rwork0.133
R-free0.16620
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)1cl6
RMSD bond length0.008
RMSD bond angle1.028
Data scaling softwareSCALEPACK (1.10.1_2155)
Phasing softwareMOLREP
Refinement softwarePHENIX
Data quality characteristics
 OverallInner shellOuter shell
Low resolution limit [Å]50.00050.0001.380
High resolution limit [Å]1.3603.6901.360
Rmerge0.0620.0250.680
Rmeas0.0660.0270.734
Rpim0.0240.0100.274
Number of reflections8750439904484
<I/σ(I)>9.1
Completeness [%]95.280.998.9
Redundancy7.26.87
CC(1/2)0.9990.840
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, SITTING DROP6.629317% PEG 10000, 0.1 M BIS-TRIS 0.1 M Ammonium acetate

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