4JDU
The crystal structure of an aerotolerance-related membrane protein from Bacteroides fragilis NCTC 9343 with multiple mutations to serines.
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | APS BEAMLINE 19-ID |
Synchrotron site | APS |
Beamline | 19-ID |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2012-12-18 |
Detector | ADSC QUANTUM 315r |
Wavelength(s) | 0.97918 |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 39.277, 49.871, 85.451 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 35.688 - 1.470 |
R-factor | 0.1825 |
Rwork | 0.182 |
R-free | 0.19770 |
Structure solution method | SAD |
RMSD bond length | 0.006 |
RMSD bond angle | 1.030 |
Data reduction software | HKL-3000 |
Data scaling software | HKL-3000 |
Phasing software | SHELXD |
Refinement software | PHENIX ((phenix.refine: 1.8.1_1168)) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 36.000 | 1.500 |
High resolution limit [Å] | 1.470 | 1.470 |
Rmerge | 0.088 | 0.496 |
Number of reflections | 29016 | |
<I/σ(I)> | 43.1 | 2.1 |
Completeness [%] | 98.9 | 91.5 |
Redundancy | 6.4 | 3.1 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 6.6 | 297 | 0.1M Bis-Tris, 25% (w/v) PEG3350, pH 6.6, VAPOR DIFFUSION, SITTING DROP, temperature 297K |