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7MTY

The crystal structure of wild type PA endonuclease (2009/H1N1/CALIFORNIA) in complex with SJ000988569

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsAPS BEAMLINE 22-BM
Synchrotron siteAPS
Beamline22-BM
Temperature [K]100
Detector technologyCCD
Collection date2021-03-24
DetectorRAYONIX MX300-HS
Wavelength(s)1.000
Spacegroup nameI 4 2 2
Unit cell lengths89.730, 89.730, 134.023
Unit cell angles90.00, 90.00, 90.00
Refinement procedure
Resolution38.440 - 2.380
R-factor0.2217
Rwork0.220
R-free0.25810
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)7k87
RMSD bond length0.002
RMSD bond angle0.547
Data reduction softwareXDS
Data scaling softwareAimless
Phasing softwareMOLREP
Refinement softwarePHENIX (1.19.2_4158)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]74.5602.470
High resolution limit [Å]2.3802.380
Rmerge0.0571.064
Rpim0.0250.461
Number of reflections113251151
<I/σ(I)>21.42
Completeness [%]99.9100
Redundancy6.26.1
CC(1/2)1.0000.747
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, HANGING DROP2910.1 M HEPES PH 7.8, 1 M AMMONIUM SULFATE, 10 MM MNCL2, 10 MM MGCL2, 0.5% PVP K15

221051

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