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1M3S

Crystal structure of YckF from Bacillus subtilis

Experimental procedure
Experimental methodMAD
Source typeSYNCHROTRON
Source detailsAPS BEAMLINE 19-ID
Synchrotron siteAPS
Beamline19-ID
Temperature [K]110
Detector technologyCCD
Collection date2002-03-17
DetectorCUSTOM-MADE
Wavelength(s)0.9795, 0.9793, 0.9537
Spacegroup nameP 65 2 2
Unit cell lengths72.080, 72.080, 245.560
Unit cell angles90.00, 90.00, 120.00
Refinement procedure
Resolution62.000

*

- 1.950
R-factor0.18897
Rwork0.187
R-free0.22400

*

Structure solution methodMAD
RMSD bond length0.024
RMSD bond angle1.814
Data reduction softwareHKL-2000
Data scaling softwared*TREK
Phasing softwareCNS
Refinement softwareREFMAC (5.0)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]60.0002.010
High resolution limit [Å]1.9501.950
Number of reflections28572
<I/σ(I)>31.65
Completeness [%]99.6100
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, HANGING DROP6.5295PEG 8000, Na cacodylate, Ca acetate, Glycerol, pH 6.5, VAPOR DIFFUSION, HANGING DROP, temperature 295K
1VAPOR DIFFUSION, HANGING DROP6.5295PEG 8000, Na cacodylate, Ca acetate, Glycerol, pH 6.5, VAPOR DIFFUSION, HANGING DROP, temperature 295K
Crystallization Reagents in Literatures
IDcrystal IDsolutionreagent nameconcentration (unit)details
11dropprotein10 (mg/ml)
21reservoirPEG800014 (%)
31reservoirsodium cacodylate80 (mM)pH6.5
41reservoircalcium acetate160 (mM)
51reservoirglycerol20 (%)

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