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4S1V

Crystal structure of phosphoglycerate oxidoreductase from Vibrio Cholerae o395

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeROTATING ANODE
Source detailsBRUKER AXS MICROSTAR
Temperature [K]100
Detector technologyIMAGE PLATE
Collection date2013-11-28
DetectorMAR scanner 345 mm plate
Wavelength(s)1.54
Spacegroup nameP 1
Unit cell lengths51.916, 83.258, 85.986
Unit cell angles64.39, 81.94, 76.03
Refinement procedure
Resolution50.000 - 2.100
R-factor0.204
Rwork0.202
R-free0.24300
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)3gg9
RMSD bond length0.006
RMSD bond angle1.068
Data reduction softwareHKL-2000
Data scaling softwareHKL-2000
Phasing softwarePHASER
Refinement softwareREFMAC (5.6.0117)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]50.0002.180
High resolution limit [Å]2.1002.100
Number of reflections70407
<I/σ(I)>15.862.69
Completeness [%]95.692.9
Redundancy3.93.5
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, HANGING DROP4.827310% PEG 3350, 10% ISOPROPANOL (V/V), 0.3M LICL, 0.1M SODIUM CITRATE, pH 4.8, VAPOR DIFFUSION, HANGING DROP, temperature 273K

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