Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | APS BEAMLINE 23-ID-D |
Synchrotron site | APS |
Beamline | 23-ID-D |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2013-11-01 |
Detector | MAR CCD 165 mm |
Wavelength(s) | 0.85506 |
Spacegroup name | P 1 |
Unit cell lengths | 854.245, 855.315, 865.907 |
Unit cell angles | 60.38, 60.43, 61.98 |
Refinement procedure
Resolution | 129.000 - 3.800 |
Rwork | 0.422 |
R-free | 0.42700 |
Data reduction software | HKL-2000 |
Data scaling software | SCALA |
Phasing software | PHASER |
Refinement software | REFMAC (5.8) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 129.000 | 3.900 |
High resolution limit [Å] | 3.800 | 3.800 |
Number of reflections | 15015304 | |
<I/σ(I)> | 2.8 | |
Completeness [%] | 53.2 | |
Redundancy | 1.6 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 7 | 293 | 100MM HEPES PH 7.0, 200MM CALCIUM ACETATE, 14% PEG550 MME, 15% GLYCEROL. |