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1T87

Crystal Structure of the Ferrous CO-bound Cytochrome P450cam (C334A)

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeROTATING ANODE
Source detailsRIGAKU
Temperature [K]100
Detector technologyIMAGE PLATE
Collection date2003-06-06
DetectorRIGAKU RAXIS IV
Wavelength(s)1.5418
Spacegroup nameP 1 21 1
Unit cell lengths67.030, 62.230, 94.920
Unit cell angles90.00, 90.48, 90.00
Refinement procedure
Resolution45.600 - 1.800
R-factor0.185
Rwork0.185
R-free0.20700
Structure solution methodMOLECULAR REPLACEMENT
RMSD bond length0.006
RMSD bond angle1.300
Data scaling softwareSCALEPACK
Phasing softwareMOLREP
Refinement softwareCNS (1.1)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]45.6001.830
High resolution limit [Å]1.8001.800
Rmerge0.0520.261
Number of reflections72208
<I/σ(I)>304.4
Completeness [%]99.498.1
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, SITTING DROP7.4290PEG 4000, potassium chloride, Tris-HCl, D-camphor, pH 7.4, VAPOR DIFFUSION, SITTING DROP, temperature 290K

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