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3MPC

The crystal structure of a Fn3-like protein from Clostridium thermocellum

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeROTATING ANODE
Source detailsBRUKER AXS MICROSTAR
Temperature [K]100
Detector technologyCCD
Collection date2008-09-24
DetectorBruker Platinum 135
Wavelength(s)1.5418
Spacegroup nameP 21 21 21
Unit cell lengths35.428, 45.731, 107.715
Unit cell angles90.00, 90.00, 90.00
Refinement procedure
Resolution25.000 - 1.600
R-factor0.16743
Rwork0.166
R-free0.19624
Structure solution methodSIRAS
RMSD bond length0.023
RMSD bond angle1.980
Data reduction softwareSAINT
Data scaling softwarePROTEUM PLUS
Phasing softwareSHELXS
Refinement softwareREFMAC (5.5.0109)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]53.8601.650
High resolution limit [Å]1.6001.600
Number of reflections23168
<I/σ(I)>24.877.16
Completeness [%]96.894.8
Redundancy5.122.36
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, SITTING DROP6.52981.6 M ammonium sulphate, 0.1 M MES monohydrate, 10% v/v 1,4-dioxane, pH 6.5, VAPOR DIFFUSION, SITTING DROP, temperature 298K

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