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4DOD

The structure of Cbescii CelA GH9 module

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeROTATING ANODE
Source detailsBRUKER AXS MICROSTAR
Temperature [K]100
Detector technologyCCD
Collection date2010-01-28
DetectorBruker Platinum 135
Wavelength(s)1.5418
Spacegroup nameP 31 2 1
Unit cell lengths147.732, 147.732, 59.017
Unit cell angles90.00, 90.00, 120.00
Refinement procedure
Resolution25.000 - 1.700
R-factor0.15603
Rwork0.155
R-free0.17942
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)1ksd
RMSD bond length0.018
RMSD bond angle1.923
Data reduction softwarePROTEUM PLUS (PLUS)
Data scaling softwarePROTEUM PLUS (PLUS)
Phasing softwareMOLREP
Refinement softwareREFMAC (5.6.0117)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]25.0001.790
High resolution limit [Å]1.7001.700
Number of reflections81332
<I/σ(I)>12.982.02
Completeness [%]100.0100
Redundancy9.166.13
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, SITTING DROP6.52941.6 M Ammonium sulfate, 0.1 M MES monohydrate pH 6.5, 10% v/v 1,4-Dioxane, VAPOR DIFFUSION, SITTING DROP, temperature 294K

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