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6CQC

RNase P protein from Thermotoga maritima in complex with 1-(4-Fluorophenyl)-2-thiourea

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsAPS BEAMLINE 21-ID-G
Synchrotron siteAPS
Beamline21-ID-G
Temperature [K]100
Detector technologyCCD
Collection date2011-11-12
DetectorMAR CCD 165 mm
Wavelength(s)0.9785
Spacegroup nameP 1 21 1
Unit cell lengths56.136, 64.264, 68.121
Unit cell angles90.00, 101.63, 90.00
Refinement procedure
Resolution46.286 - 1.540
R-factor0.1811
Rwork0.180
R-free0.19900
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)1nz0
RMSD bond length0.007
RMSD bond angle0.703
Data reduction softwareXDS
Data scaling softwareAimless
Phasing softwarePHASER
Refinement softwarePHENIX ((1.13_2998))
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]46.2901.570
High resolution limit [Å]1.5401.540
Rmerge0.0440.237
Rmeas0.0530.287
Rpim0.0290.195
Number of reflections679772724
<I/σ(I)>19.53.7
Completeness [%]96.978.5
Redundancy3.22.9
CC(1/2)0.9930.915
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, SITTING DROP4.8292P protein from T. maritima in 50 mM Tris-HCl pH 7.5, 0.2 mM EDTA was crystallized at 3 mg/mL in 12% PEG-1000, 100 mm sodium acetate pH 4.8 and 200 mM potassium sulfate

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