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2W5U

Flavodoxin from Helicobacter pylori in complex with the C3 inhibitor

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeROTATING ANODE
Source detailsBRUKER AXS MICROSTAR
Temperature [K]120
Detector technologyCCD
Collection date2008-05-10
DetectorENRAF-NONIUS
Spacegroup nameP 1 21 1
Unit cell lengths38.533, 50.967, 72.806
Unit cell angles90.00, 98.64, 90.00
Refinement procedure
Resolution22.000 - 2.620
R-factor0.227
Rwork0.227
R-free0.26400
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)1fue
RMSD bond length0.011
RMSD bond angle1.580
Data reduction softwareDENZO
Data scaling softwareSCALEPACK
Phasing softwareMOLREP
Refinement softwareCNS (1.0)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]22.0002.700
High resolution limit [Å]2.6202.600
Rmerge0.1100.260
Number of reflections8523
<I/σ(I)>9.77.9
Completeness [%]99.898.7
Redundancy63.5
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1

224201

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