4C2F
Crystal structure of the CtpB R168A mutant present in an active conformation
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SLS BEAMLINE X06DA |
Synchrotron site | SLS |
Beamline | X06DA |
Temperature [K] | 100 |
Detector technology | CCD |
Detector | MARRESEARCH |
Spacegroup name | P 32 2 1 |
Unit cell lengths | 117.909, 117.909, 72.048 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 20.000 - 2.400 |
R-factor | 0.215 |
Rwork | 0.215 |
R-free | 0.26460 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 4c2c |
RMSD bond length | 0.007 |
RMSD bond angle | 1.300 |
Data reduction software | DENZO |
Data scaling software | SCALEPACK |
Phasing software | PHASER |
Refinement software | CNS |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 19.660 | 2.530 |
High resolution limit [Å] | 2.400 | 2.400 |
Rmerge | 0.010 | 0.340 |
Number of reflections | 22841 | |
<I/σ(I)> | 44.4 | 2.9 |
Completeness [%] | 99.7 | 100 |
Redundancy | 2.8 | 2.9 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | 2.1 M NA-MALONATE PH 7.8 |