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5CY2

Tn3 resolvase - site III complex crystal form II

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsAPS BEAMLINE 19-ID
Synchrotron siteAPS
Beamline19-ID
Temperature [K]80
Detector technologyCCD
Collection date2006-03-04
DetectorADSC QUANTUM 315
Wavelength(s)0.97948
Spacegroup nameC 1 2 1
Unit cell lengths144.900, 151.920, 106.140
Unit cell angles90.00, 99.85, 90.00
Refinement procedure
Resolution49.247 - 4.000
R-factor0.2094
Rwork0.207
R-free0.24980
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)D_1000212338
RMSD bond length0.010
RMSD bond angle1.090
Data reduction softwareHKL-2000
Data scaling softwareHKL-2000
Phasing softwareMOLREP
Refinement softwarePHENIX (dev_2067)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]100.0004.070
High resolution limit [Å]4.0004.000
Number of reflections19099
<I/σ(I)>22.91
Completeness [%]99.596
Redundancy3.52.6
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, HANGING DROP7.5290complex + well mixed 1:1 complex: 3mg/ml in 25mM tris pH 7.5 and 0.14M (NH4)2SO4 well: 16% PEG3350, 0.2M ammonium flouride cryoprotectant: added 20% ethylene glycol

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