4I86
Crystal structure of PilZ domain of CeSA from cellulose synthesizing bacterium
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | PHOTON FACTORY BEAMLINE BL-5A |
Synchrotron site | Photon Factory |
Beamline | BL-5A |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2011-10-05 |
Detector | ADSC QUANTUM 210r |
Wavelength(s) | 1.0000 |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 39.360, 59.500, 78.153 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 35.153 - 2.098 |
R-factor | 0.2167 |
Rwork | 0.214 |
R-free | 0.26130 |
Structure solution method | MOLECULAR REPLACEMENT |
RMSD bond length | 0.008 |
RMSD bond angle | 1.147 |
Data reduction software | XDS |
Data scaling software | XDS |
Phasing software | PHENIX ((AutoMR: 1.7.1_743)) |
Refinement software | PHENIX ((phenix.refine: 1.7.1_743)) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 45.000 | 2.220 |
High resolution limit [Å] | 2.098 | 2.100 |
Rmerge | 0.081 | 0.618 |
Number of reflections | 11236 | |
<I/σ(I)> | 24.52 | 4.5 |
Completeness [%] | 99.9 | 99.7 |
Redundancy | 10.7 | 10.8 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 3.8 | 293 | 0.1M phosphate-citrate, 30%(v/v) PEG300, pH 3.8, VAPOR DIFFUSION, HANGING DROP, temperature 293K |