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1R86

Crystal structure of the extracellular xylanase from Geobacillus stearothermophilus T-6 (XT6, monoclinic form): The E159A/E265A mutant at 1.8A resolution

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeROTATING ANODE
Source detailsRIGAKU
Temperature [K]100
Detector technologyIMAGE PLATE
Collection date2001-10-25
DetectorRIGAKU RAXIS IV++
Spacegroup nameC 1 2 1
Unit cell lengths121.244, 61.251, 89.463
Unit cell angles90.00, 119.28, 90.00
Refinement procedure
Resolution40.000 - 1.800
R-factor0.181
Rwork0.181
R-free0.21500
Structure solution methodAB INITIO PHASING
Starting model (for MR)PDB code 1R85
RMSD bond length0.020
RMSD bond angle1.900
Data reduction softwareDENZO
Data scaling softwareSCALEPACK
Phasing softwareCNS
Refinement softwareCNS (1.0)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]40.0001.830
High resolution limit [Å]1.8001.800
Rmerge0.0500.481
Number of reflections48254
<I/σ(I)>13.3
Completeness [%]90.990.5
Redundancy2.5
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, HANGING DROP6.529314% PEG 4000, MES buffer pH 6.5, 10mM ZnSO4, VAPOR DIFFUSION, HANGING DROP, temperature 293K

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