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3LQC

X-ray crystal structure of oxidized XRCC1 bound to DNA pol beta Palm thumb domain

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeROTATING ANODE
Source detailsRIGAKU MICROMAX-007
Temperature [K]100
Detector technologyCCD
Collection date2008-09-01
DetectorRIGAKU SATURN 92
Wavelength(s)1.5418
Spacegroup nameP 31 2 1
Unit cell lengths75.240, 75.240, 126.160
Unit cell angles90.00, 90.00, 120.00
Refinement procedure
Resolution24.628 - 2.349
R-factor0.192
Rwork0.189
R-free0.25000
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)1xna
RMSD bond length0.006
RMSD bond angle0.920
Data scaling softwareXSCALE
Phasing softwarePHASER
Refinement softwarePHENIX
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]30.0002.410
High resolution limit [Å]2.3502.350
Rmerge0.1220.517
Number of reflections177651270
<I/σ(I)>19.024.2
Completeness [%]99.899
Redundancy10.37.1
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, HANGING DROP7.529820-25% PEG 3350, 0.2-0.3M TRI-POTASSIUM CITRATE, PH 7.5, VAPOR DIFFUSION, HANGING DROP, temperature 298K

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