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2HNI

Crystal Structure Of Biotin Protein Ligase From Pyrococcus Horikoshii OT3, K111A mutation

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeROTATING ANODE
Source detailsRIGAKU
Temperature [K]100
Detector technologyIMAGE PLATE
Collection date2005-11-08
DetectorRIGAKU RAXIS IV
Wavelength(s)1.5418
Spacegroup nameP 1 21 1
Unit cell lengths38.362, 82.740, 72.945
Unit cell angles90.00, 103.62, 90.00
Refinement procedure
Resolution22.720 - 1.900
R-factor0.199
Rwork0.199
R-free0.22500
Structure solution methodFOURIER SYNTHESIS
Starting model (for MR)2djz
RMSD bond length0.006
RMSD bond angle1.200
Data reduction softwareHKL-2000
Data scaling softwareSCALEPACK
Phasing softwareCNS
Refinement softwareCNS
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]50.0001.970
High resolution limit [Å]1.9001.900
Rmerge0.0480.286
Number of reflections34116
<I/σ(I)>16.83.4
Completeness [%]97.784
Redundancy3.42.5
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, SITTING DROP5.2295PEG 20000, Acetate, NaOH, pH 5.2, VAPOR DIFFUSION, SITTING DROP, temperature 295K

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