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4JB4

Expression, Purification, Characterization, and Solution NMR Study of Highly Deuterated Yeast Cytochrome c Peroxidase with Enhanced Solubility

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeROTATING ANODE
Source detailsRIGAKU MICROMAX-007 HF
Temperature [K]200
Detector technologyCCD
Collection date2011-05-04
DetectorRIGAKU SATURN 944+
Wavelength(s)1.5418
Spacegroup nameP 1 21 1
Unit cell lengths45.052, 87.920, 87.526
Unit cell angles90.00, 105.14, 90.00
Refinement procedure
Resolution43.570 - 2.390
R-factor0.2156
Rwork0.212
R-free0.27937
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)1zby
RMSD bond length0.018
RMSD bond angle1.663
Data reduction softwareHKL-3000
Data scaling softwareHKL-3000
Refinement softwareREFMAC (5.5.0109)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]50.0002.450
High resolution limit [Å]2.3902.390
Rmerge0.158
Completeness [%]99.090.17
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, HANGING DROP52980.2M NH4Cl, 0.1 M CH3COONa pH5.0 and 20% w/v PEG 6000, VAPOR DIFFUSION, HANGING DROP, temperature 298K

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