5DRO
Structure of the Aquifex aeolicus LpxC/LPC-011 Complex
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | APS BEAMLINE 22-ID |
| Synchrotron site | APS |
| Beamline | 22-ID |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2015-04-27 |
| Detector | RAYONIX MX300-HS |
| Wavelength(s) | 1 |
| Spacegroup name | P 21 21 21 |
| Unit cell lengths | 54.820, 74.680, 135.870 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 67.935 - 2.010 |
| R-factor | 0.1575 |
| Rwork | 0.156 |
| R-free | 0.18640 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 3p3c |
| RMSD bond length | 0.002 |
| RMSD bond angle | 0.694 |
| Data scaling software | XSCALE |
| Phasing software | PHASER (2.5.6) |
| Refinement software | PHENIX |
Data quality characteristics
| Overall | Inner shell | Outer shell | |
| Low resolution limit [Å] | 67.940 | 2.060 | |
| High resolution limit [Å] | 2.010 | 8.990 | 2.010 |
| Rmerge | 0.038 | 0.534 | |
| Rmeas | 0.124 | 0.040 | 0.562 |
| Total number of observations | 545255 | ||
| Number of reflections | 37995 | 514 | 2742 |
| <I/σ(I)> | 21.63 | 53.15 | 4.54 |
| Completeness [%] | 100.0 | 99.4 | 100 |
| Redundancy | 14.4 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 7 | 293 | 0.05 M ammonium acetate 10% PEG3350 |
