5IXH
Crystal Structure of Burkholderia cenocepacia BcnA
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | CLSI BEAMLINE 08ID-1 |
Synchrotron site | CLSI |
Beamline | 08ID-1 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2015-08-15 |
Detector | RAYONIX MX300HE |
Wavelength(s) | 0.97949 |
Spacegroup name | P 61 |
Unit cell lengths | 93.970, 93.970, 76.660 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 34.676 - 1.400 |
R-factor | 0.1577 |
Rwork | 0.156 |
R-free | 0.18320 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 2fgs |
RMSD bond length | 0.010 |
RMSD bond angle | 1.464 |
Data reduction software | MOSFLM |
Data scaling software | Aimless (0.1.26) |
Phasing software | PHASER |
Refinement software | PHENIX (1.9_1692) |
Data quality characteristics
Overall | Inner shell | Outer shell | |
Low resolution limit [Å] | 35.940 | 35.940 | 1.430 |
High resolution limit [Å] | 1.400 | 7.410 | 1.400 |
Rmerge | 0.063 | 0.041 | 0.545 |
Rmeas | 0.066 | ||
Rpim | 0.020 | ||
Total number of observations | 796780 | ||
Number of reflections | 75559 | ||
<I/σ(I)> | 17.1 | ||
Completeness [%] | 99.9 | 93.2 | 99.4 |
Redundancy | 10.5 | 10.1 | 5.7 |
CC(1/2) | 0.999 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 8 | 294 | Tris, ammonium sulphate |