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4RG8

Structural and biochemical studies of a moderately thermophilic Exonuclease I from Methylocaldum szegediense

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsDIAMOND BEAMLINE I02
Synchrotron siteDiamond
BeamlineI02
Temperature [K]100
Wavelength(s)0.9795
Spacegroup nameP 21 21 21
Unit cell lengths60.967, 97.020, 111.411
Unit cell angles90.00, 90.00, 90.00
Refinement procedure
Resolution29.080 - 2.120
R-factor0.22433
Rwork0.223
R-free0.25292
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)1fxx
RMSD bond length0.005
RMSD bond angle1.029
Data reduction softwarexia2
Data scaling softwarexia2
Phasing softwarePHASER
Refinement softwareREFMAC (5.8.0049)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]29.0802.170
High resolution limit [Å]2.1202.120
Number of reflections36277
Completeness [%]99.294.92
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, SITTING DROP829820% PEG6K, 0.1 M Tris pH8, 0.2 M calcium chloride , VAPOR DIFFUSION, SITTING DROP, temperature 298K

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