3ZUI
OMCI in complex with palmitoleic acid
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | ESRF BEAMLINE ID14-2 |
| Synchrotron site | ESRF |
| Beamline | ID14-2 |
| Temperature [K] | 120 |
| Detector technology | CCD |
| Collection date | 2006-07-24 |
| Detector | ADSC QUANTUM 4 |
| Spacegroup name | P 21 21 21 |
| Unit cell lengths | 44.430, 51.890, 68.400 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 37.260 - 1.710 |
| R-factor | 0.1981 |
| Rwork | 0.197 |
| R-free | 0.22280 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 2cm4 |
| RMSD bond length | 0.006 |
| RMSD bond angle | 0.930 |
| Data reduction software | XDS |
| Data scaling software | SCALA |
| Phasing software | PHASER |
| Refinement software | BUSTER (2.11.1) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 68.400 | 1.810 |
| High resolution limit [Å] | 1.710 | 1.710 |
| Rmerge | 0.040 | 0.380 |
| Number of reflections | 15720 | |
| <I/σ(I)> | 21.7 | 2 |
| Completeness [%] | 89.8 | 62.2 |
| Redundancy | 3.8 | 2.2 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | 8.5 | 30% PEG 4000, 0.2 M MGCL2, 0.1 M TRIS PH 8.5. |
