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8VNO

Homing endonuclease I-PpoI-DNA complex:reaction at pH6.0 (K+ MES) with 500 uM Mn2+ for 600s

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsAPS BEAMLINE 21-ID-F
Synchrotron siteAPS
Beamline21-ID-F
Temperature [K]100
Detector technologyIMAGE PLATE
Collection date2023-03-28
DetectorMAR scanner 300 mm plate
Wavelength(s)0.9765
Spacegroup nameP 31 2 1
Unit cell lengths114.060, 114.060, 88.020
Unit cell angles90.00, 90.00, 120.00
Refinement procedure
Resolution47.860 - 1.700
R-factor0.1794
Rwork0.179
R-free0.19320
Structure solution methodMOLECULAR REPLACEMENT
RMSD bond length0.009
RMSD bond angle1.206
Data reduction softwareXDS
Data scaling softwareXSCALE
Phasing softwareMOLREP
Refinement softwarePHENIX ((1.20.1_4487: ???))
Data quality characteristics
 OverallInner shellOuter shell
Low resolution limit [Å]47.86047.8601.800
High resolution limit [Å]1.7005.0701.700
Rmerge0.0770.0320.877
Rmeas0.0850.0350.968
Number of reflections142915539622937
<I/σ(I)>13.47
Completeness [%]99.8
Redundancy11.1
CC(1/2)0.9990.9990.725
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, HANGING DROP62980.2 M Sodium Malonate, PEG 3350, 0.1 M MES

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