4MCX
P. vulgaris HIGBA structure, crystal form 2
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | APS BEAMLINE 24-ID-E |
Synchrotron site | APS |
Beamline | 24-ID-E |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2011-01-01 |
Detector | ADSC QUANTUM 315 |
Spacegroup name | P 62 |
Unit cell lengths | 120.503, 120.503, 64.450 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 30.790 - 2.100 |
R-factor | 0.174 |
Rwork | 0.173 |
R-free | 0.21100 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 4mct |
RMSD bond length | 0.011 |
RMSD bond angle | 1.179 |
Data reduction software | XDS |
Data scaling software | XDS |
Phasing software | PHASER (2.3.0) |
Refinement software | PHENIX (1.8.4_1496) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 31.000 | 2.170 |
High resolution limit [Å] | 2.100 | 2.100 |
Rmerge | 0.079 | 0.957 |
Number of reflections | 30863 | |
<I/σ(I)> | 17.3 | 1.7 |
Completeness [%] | 99.9 | 99.9 |
Redundancy | 5.5 | 5.5 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | 4.6 | 293.15 | 25% PEG 4000, 90 mM sodium acetate pH 4.6, 180 mM ammonium acetate, 4% acetone (w/v), VAPOR DIFFUSION, SITTING DROP, temperature 293.15K |