8CSB
WbbB D232N in complex with CMP-beta-Kdo
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 | 2017-07-28 |
Detector | RAYONIX MX300HE |
Wavelength(s) | 0.9795 |
Spacegroup name | C 2 2 21 |
Unit cell lengths | 92.710, 157.440, 120.060 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 47.990 - 2.250 |
R-factor | 0.205 |
Rwork | 0.203 |
R-free | 0.24440 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 5fa1 |
RMSD bond length | 0.015 |
RMSD bond angle | 1.369 |
Data reduction software | XDS |
Data scaling software | XSCALE |
Phasing software | PHASER |
Refinement software | PHENIX (1.19_4092) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 48.000 | 2.310 |
High resolution limit [Å] | 2.250 | 2.250 |
Number of reflections | 41916 | 3016 |
<I/σ(I)> | 11.71 | 1.96 |
Completeness [%] | 99.8 | |
Redundancy | 6.4 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 7.5 | 293 | 100 mM NaCl, 100 mM HEPES, 1.6 M ammonium sulphate |