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2P50

Crystal structure of N-acetyl-D-Glucosamine-6-Phosphate deacetylase liganded with Zn

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsNSLS BEAMLINE X4A
Synchrotron siteNSLS
BeamlineX4A
Temperature [K]100
Detector technologyCCD
Collection date2006-03-11
DetectorADSC QUANTUM 4
Wavelength(s)0.98000
Spacegroup nameC 2 2 21
Unit cell lengths95.183, 117.992, 265.604
Unit cell angles90.00, 90.00, 90.00
Refinement procedure
Resolution24.960 - 2.200
R-factor0.212
Rwork0.212
R-free0.25700
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)1ymy
RMSD bond length0.006
RMSD bond angle1.300
Data reduction softwareDENZO
Data scaling softwareSCALEPACK
Phasing softwarePHASER
Refinement softwareCNS (1.1)
Data quality characteristics
 Overall
Low resolution limit [Å]25.000
High resolution limit [Å]2.200
Rmerge0.055
Number of reflections72816
Completeness [%]95.9
Redundancy6.2
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, HANGING DROP8.529325% PEG 3350, 0.1M Tris-HCl, 0.2M Zinc chloride, pH 8.5, VAPOR DIFFUSION, HANGING DROP, temperature 293.0K

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