6ANS
Crystal structure of a putative uncharacterized protein from Burkholderia cenocepacia
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | APS BEAMLINE 21-ID-F |
Synchrotron site | APS |
Beamline | 21-ID-F |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2017-06-23 |
Detector | RAYONIX MX-300 |
Wavelength(s) | 0.97872 |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 62.100, 134.470, 98.080 |
Unit cell angles | 90.00, 90.43, 90.00 |
Refinement procedure
Resolution | 46.071 - 2.200 |
R-factor | 0.1513 |
Rwork | 0.150 |
R-free | 0.18840 |
Structure solution method | SAD |
RMSD bond length | 0.008 |
RMSD bond angle | 0.911 |
Data reduction software | XDS |
Data scaling software | XSCALE |
Phasing software | PHASER (2.7.17) |
Refinement software | PHENIX (dev_2849) |
Data quality characteristics
Overall | Inner shell | Outer shell | |
Low resolution limit [Å] | 46.071 | 50.000 | 2.260 |
High resolution limit [Å] | 2.200 | 9.840 | 2.200 |
Rmerge | 0.085 | 0.027 | 0.528 |
Rmeas | 0.099 | 0.032 | 0.612 |
Number of reflections | 81463 | 1737 | 11897 |
<I/σ(I)> | 12.6 | 32.06 | 2.84 |
Completeness [%] | 99.8 | 97.2 | 99.9 |
Redundancy | 3.863 | 3.596 | 3.882 |
CC(1/2) | 0.997 | 0.998 | 0.879 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 6.5 | 289 | Microlytic MCSG 1 screen, B1 (100 mM MES/sodium hydroxide, pH 6.5, 20% w/v PEG4000, 0.6 M sodium chloride), 20 mg/mL BuceA.18021.a.A1.PD00490 (SE-MET), cryoprotectant: 20% ethylene glycol, tray 290946 B1, puck QUF9-5 |