5A0L
N-terminal thioester domain of fibronectin-binding protein SfbI from Streptococcus pyogenes
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | DIAMOND BEAMLINE I04 |
Synchrotron site | Diamond |
Beamline | I04 |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2014-07-10 |
Detector | DECTRIS PILATUS |
Spacegroup name | I 41 |
Unit cell lengths | 165.120, 165.120, 42.520 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 52.220 - 1.350 |
R-factor | 0.13173 |
Rwork | 0.131 |
R-free | 0.15269 |
Structure solution method | SAD |
Starting model (for MR) | NONE |
RMSD bond length | 0.012 |
RMSD bond angle | 1.528 |
Data reduction software | xia2 |
Data scaling software | xia2 |
Phasing software | PHENIX |
Refinement software | REFMAC (5.8.0073) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 52.220 | 1.390 |
High resolution limit [Å] | 1.350 | 1.350 |
Rmerge | 0.050 | 0.750 |
Number of reflections | 126127 | |
<I/σ(I)> | 18.7 | 2.7 |
Completeness [%] | 99.9 | 99.1 |
Redundancy | 9.2 | 9.1 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | 7.5 | 0.1 M ZINC ACETATE, 0.1 M HEPES PH 7.5, 14% PEG 8000 |