4AUI
STRUCTURE AND FUNCTION OF THE PORB PORIN FROM DISSEMINATING N. GONORRHOEAE
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SLS BEAMLINE X10SA |
Synchrotron site | SLS |
Beamline | X10SA |
Temperature [K] | 100 |
Detector technology | CCD |
Detector | MARMOSAIC 225 mm CCD |
Spacegroup name | C 1 2 1 |
Unit cell lengths | 114.050, 111.470, 88.340 |
Unit cell angles | 90.00, 102.07, 90.00 |
Refinement procedure
Resolution | 38.050 - 3.200 |
R-factor | 0.2236 |
Rwork | 0.221 |
R-free | 0.26790 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 3A2R |
RMSD bond length | 0.022 |
RMSD bond angle | 1.938 |
Data reduction software | XDS |
Data scaling software | XSCALE |
Phasing software | MOLREP |
Refinement software | PHENIX ((PHENIX.REFINE)) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 38.000 | 3.400 |
High resolution limit [Å] | 3.200 | 3.200 |
Rmerge | 0.230 | 0.920 |
Number of reflections | 14044 | |
<I/σ(I)> | 5.9 | 1.7 |
Completeness [%] | 98.0 | 95.4 |
Redundancy | 3.9 | 3.8 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | 7 | pH 7 |