4D5U
Structure of OmpF in I2
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | ALBA BEAMLINE XALOC |
| Synchrotron site | ALBA |
| Beamline | XALOC |
| Temperature [K] | 140 |
| Detector technology | PIXEL |
| Collection date | 2013-03-15 |
| Detector | DECTRIS PILATUS 6M |
| Spacegroup name | I 1 2 1 |
| Unit cell lengths | 159.730, 115.690, 222.854 |
| Unit cell angles | 90.00, 104.95, 90.00 |
Refinement procedure
| Resolution | 24.834 - 3.500 |
| R-factor | 0.232 |
| Rwork | 0.229 |
| R-free | 0.28270 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 2zfg |
| RMSD bond length | 0.009 |
| RMSD bond angle | 1.252 |
| Data reduction software | MOSFLM |
| Data scaling software | Aimless |
| Phasing software | PHASER |
| Refinement software | PHENIX ((PHENIX.REFINE: 1.8.2_1309)) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 25.000 | 3.610 |
| High resolution limit [Å] | 3.500 | 3.500 |
| Rmerge | 0.170 | 0.440 |
| Number of reflections | 48149 | |
| <I/σ(I)> | 4.5 | 1.8 |
| Completeness [%] | 97.6 | 97.9 |
| Redundancy | 2.5 | 2.4 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | 8 | 16% PEG 4000, 0.4 M NACL AND 10 MM CDCL2 AS AN ADDITIVE, pH 8 |
