5LJ8
Structure of the E. coli MacB periplasmic domain (P21)
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | DIAMOND BEAMLINE I24 |
Synchrotron site | Diamond |
Beamline | I24 |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2014-09-09 |
Detector | DECTRIS PILATUS3 6M |
Wavelength(s) | 0.96861 |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 50.110, 54.860, 66.890 |
Unit cell angles | 90.00, 92.86, 90.00 |
Refinement procedure
Resolution | 32.870 - 1.950 |
R-factor | 0.18043 |
Rwork | 0.178 |
R-free | 0.22772 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 3ftj |
RMSD bond length | 0.017 |
RMSD bond angle | 1.659 |
Data reduction software | iMOSFLM |
Data scaling software | Aimless |
Phasing software | PHASER |
Refinement software | REFMAC (5.8.0069) |
Data quality characteristics
Overall | |
Low resolution limit [Å] | 66.810 |
High resolution limit [Å] | 1.950 |
Number of reflections | 25260 |
<I/σ(I)> | 8.1 |
Completeness [%] | 99.8 |
Redundancy | 3.4 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 288 | 30% Pentaerythritol ethoxylate (15/4 EO/OH), 6% polyvinylpyrrolidone, 100mM HEPES pH 7.5 |