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1Q5I

Crystal structure of bacteriorhodopsin mutant P186A crystallized from bicelles

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsALS BEAMLINE 8.2.2
Synchrotron siteALS
Beamline8.2.2
Temperature [K]100
Detector technologyCCD
Collection date2003-05-22
DetectorADSC QUANTUM 315
Wavelength(s)1.0332
Spacegroup nameP 1 21 1
Unit cell lengths44.629, 108.721, 56.093
Unit cell angles90.00, 113.46, 90.00
Refinement procedure
Resolution500.000 - 2.300
R-factor0.198
Rwork0.194
R-free0.25500

*

Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)1py6
RMSD bond length0.008
RMSD bond angle1.200
Data reduction softwareDENZO
Data scaling softwareSCALEPACK
Phasing softwareCNS
Refinement softwareCNS
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]500.0002.280
High resolution limit [Å]2.2002.200
Rmerge0.116
Number of reflections24112
<I/σ(I)>23
Completeness [%]96.692.4
Redundancy4
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1unknown

*

3.7

*

310DMPC, CHAPSO, sodium phosphate, hexanediol, pH 4.0, VAPOR DIFFUSION, HANGING DROP, temperature 310.0K
Crystallization Reagents in Literatures
IDcrystal IDsolutionreagent nameconcentration (unit)details
11reservoir2 (M)pH4.5
21reservoir0.8 (M)pH3.7
31reservoirhexanediol0.09 (M)

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