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2QLA

Crystal Structure of a 16-Helix Bundle Architecture Produced by the Zinc-Mediated Self Assembly of Four Cytochrome cb562 Molecules

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeROTATING ANODE
Source detailsSIEMENS
Detector technologyCCD
Collection date2007-03-16
DetectorAPEX II CCD
Wavelength(s)1.5418
Spacegroup nameP 21 21 2
Unit cell lengths88.984, 66.659, 68.901
Unit cell angles90.00, 90.00, 90.00
Refinement procedure
Resolution50.000 - 2.900
R-factor0.248
Rwork0.248
R-free0.29500
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)2bc5
RMSD bond length0.018
RMSD bond angle1.331
Data reduction softwareSAINT
Phasing softwareCNS
Refinement softwareCNS
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]50.0002.990
High resolution limit [Å]2.9002.900
Rmerge0.1610.420
Number of reflections10032
<I/σ(I)>5.771.5
Completeness [%]85.166.2
Redundancy2.97
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, SITTING DROP7293100mM Tris, 1.25 mM ZnCl2, 25% PEG 3350, pH 7, VAPOR DIFFUSION, SITTING DROP, temperature 293K

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