7R4B
The Bacillus pumilus chorismate mutase
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | BESSY BEAMLINE 14.2 |
Synchrotron site | BESSY |
Beamline | 14.2 |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2019-10-02 |
Detector | DECTRIS PILATUS3 2M |
Wavelength(s) | 0.9184 |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 49.898, 94.864, 77.305 |
Unit cell angles | 90.00, 107.49, 90.00 |
Refinement procedure
Resolution | 24.580 - 1.100 |
Rwork | 0.182 |
R-free | 0.19650 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 3zo8 |
RMSD bond length | 0.009 |
RMSD bond angle | 1.433 |
Data reduction software | XDS (0.86) |
Phasing software | PHASER (2.8.2) |
Refinement software | PHENIX (1.20) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 24.580 | 1.139 |
High resolution limit [Å] | 1.100 | 1.100 |
Rpim | 0.030 | 0.900 |
Number of reflections | 227592 | 6262 |
<I/σ(I)> | 12.99 | 0.65 |
Completeness [%] | 78.3 | 22.6 |
Redundancy | 4.3 | 3.1 |
CC(1/2) | 0.999 | 0.244 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 6.5 | 298 | 0.1M MES pH 6.5 25% PEG 1500 |