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2I1W

Crystal structure of NAD kinase 1 from Listeria monocytogenes

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsESRF BEAMLINE BM30A
Synchrotron siteESRF
BeamlineBM30A
Temperature [K]100
Collection date2004-05-05
Spacegroup nameP 1 21 1
Unit cell lengths66.612, 119.017, 67.937
Unit cell angles90.00, 102.08, 90.00
Refinement procedure
Resolution34.370 - 2.340
R-factor0.19607
Rwork0.194
R-free0.25696
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)1u0r
RMSD bond length0.013
RMSD bond angle1.374
Data reduction softwareMOSFLM
Data scaling softwareSCALA
Phasing softwarePHASER
Refinement softwareREFMAC (5.2.0005)
Data quality characteristics
 Overall
Low resolution limit [Å]34.370
High resolution limit [Å]2.340
Rmerge0.066
Number of reflections42609
<I/σ(I)>13.9
Completeness [%]97.5
Redundancy3.5
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, HANGING DROP5.40.3 M potassium chloride, 50 mM tri-sodium citrate, 15-20% w/v polyethylene glycol 400, 10 mM KI, pH 5.4, VAPOR DIFFUSION, HANGING DROP, pH 5.40

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