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429D

CRYSTAL STRUCTURE OF A LEADZYME; METAL BINDING AND IMPLICATIONS FOR CATALYSIS

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsSSRL BEAMLINE BL7-1
Synchrotron siteSSRL
BeamlineBL7-1
Temperature [K]100
Detector technologyIMAGE PLATE
Collection date1998-05-07
DetectorMARRESEARCH
Spacegroup nameP 61 2 2
Unit cell lengths60.400, 60.400, 133.100
Unit cell angles90.00, 90.00, 120.00
Refinement procedure
Resolution25.000 - 2.700
R-factor0.254

*

Rwork0.255
R-free0.27400

*

Structure solution methodMAD PHASING USING 5 HEAVY ATOM DERIVATIVES (INCLUDING PB(II))
RMSD bond length0.009
RMSD bond angle1.350

*

Data reduction softwareDENZO
Data scaling softwareSCALEPACK
Phasing softwareSHARP
Refinement softwareCNS
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]25.0002.750
High resolution limit [Å]2.7002.700
Rmerge0.0640.210
Number of reflections4416
Completeness [%]96.655.4
Redundancy53
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, HANGING DROP620

*

pH 6.0, VAPOR DIFFUSION, HANGING DROP, temperature 293.0K
Crystallization Reagents
IDcrystal IDsolution IDreagent nameconcentrationdetails
111MAGNESIUM ACETATE
211SODIUM CACODYLATE
311SPERMINE
411MPD
512MPD
Crystallization Reagents in Literatures
IDcrystal IDsolutionreagent nameconcentration (unit)details
11dropRNA0.8 (mM)
21dropNa cacodylate10 (mM)
31reservoirMPD20-25 (%)
41reservoirspermine-HCl1 (mM)
51reservoir20 (mM)
61reservoirNa cacodylate50 (mM)

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