5ENP
MBX2931 bound structure of bacterial efflux pump.
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SOLEIL BEAMLINE PROXIMA 1 |
Synchrotron site | SOLEIL |
Beamline | PROXIMA 1 |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2015-06-06 |
Detector | DECTRIS PILATUS 6M |
Wavelength(s) | 0.97857 |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 108.646, 145.336, 174.218 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 50.000 - 1.900 |
R-factor | 0.18367 |
Rwork | 0.182 |
R-free | 0.22154 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 5en5 |
RMSD bond length | 0.018 |
RMSD bond angle | 1.822 |
Data reduction software | XDS |
Data scaling software | XDS |
Phasing software | PHASER |
Refinement software | REFMAC (5.8.0131) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 50.000 | 2.010 |
High resolution limit [Å] | 1.900 | 1.900 |
Rmerge | 0.116 | 1.438 |
Number of reflections | 216569 | |
<I/σ(I)> | 9.34 | |
Completeness [%] | 99.6 | 98.1 |
Redundancy | 8.1 | 7.9 |
CC(1/2) | 0.997 | 0.460 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 291 | 0.1 M MES pH6.5, 0.21 M NaCl, 11.5% PEG4000 |