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4JJJ

The structure of T. fusca GH48 D224N mutant

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeROTATING ANODE
Source detailsBRUKER AXS MICROSTAR
Temperature [K]100
Detector technologyCCD
Collection date2012-04-30
DetectorBruker Platinum 135
Wavelength(s)1.5418
Spacegroup nameP 1 21 1
Unit cell lengths56.458, 88.494, 66.753
Unit cell angles90.00, 113.72, 90.00
Refinement procedure
Resolution25.000 - 1.600
R-factor0.12351
Rwork0.121
R-free0.16379
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)4fus
RMSD bond length0.023
RMSD bond angle2.152
Data reduction softwarePROTEUM PLUS (PLUS)
Data scaling softwarePROTEUM PLUS (PLUS)
Phasing softwareMOLREP
Refinement softwareREFMAC (5.7.0032)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]25.0001.700
High resolution limit [Å]1.6001.600
Number of reflections78727
<I/σ(I)>15.13.81
Completeness [%]99.493.9
Redundancy7.933.32
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, SITTING DROP6.52940.1 M sodium cacodylate trihydrate pH 6.5, 18% (w/v) PEG 8000 and 20 mM zinc acetate dihydrate, VAPOR DIFFUSION, SITTING DROP, temperature 294K

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