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1J2U

Creatininase Zn

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsPHOTON FACTORY BEAMLINE BL-6B
Synchrotron sitePhoton Factory
BeamlineBL-6B
Temperature [K]100
Detector technologyCCD
Collection date2002-11-23
DetectorADSC QUANTUM 4
Wavelength(s)1.000
Spacegroup nameP 21 21 21
Unit cell lengths102.114, 151.449, 167.633
Unit cell angles90.00, 90.00, 90.00
Refinement procedure
Resolution40.000 - 1.850
R-factor0.18707
Rwork0.186
R-free0.20100

*

Structure solution methodD-Fourier
RMSD bond length0.008

*

RMSD bond angle1.072

*

Data reduction softwareMOSFLM
Data scaling softwareCCP4 ((SCALA))
Refinement softwareREFMAC (5.0)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]40.000
High resolution limit [Å]1.8501.850
Rmerge0.0470.335
Number of reflections218133
<I/σ(I)>10.7
Completeness [%]98.999.7
Redundancy4.84
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, HANGING DROP7.52931.5M Li sulfate, 0.1M Na HEPES, pH 7.5, VAPOR DIFFUSION, HANGING DROP, temperature 293K
Crystallization Reagents in Literatures
IDcrystal IDsolutionreagent nameconcentration (unit)details
11dropprotein35 (mg/ml)
21dropHEPES0.1 (M)pH7.5
31reservoirlithium sulfate1.5 (M)
41reservoirHEPES0.1 (M)pH7.5

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