4A3U
X-structure of the old yellow enzyme homologue from zymomonas mobilis (NCR)
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SLS BEAMLINE X06SA |
| Synchrotron site | SLS |
| Beamline | X06SA |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2006-11-23 |
| Detector | MARRESEARCH |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 52.600, 90.500, 76.600 |
| Unit cell angles | 90.00, 108.30, 90.00 |
Refinement procedure
| Resolution | 43.060 - 1.700 |
| R-factor | 0.24205 |
| Rwork | 0.239 |
| R-free | 0.30275 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 2gqa |
| RMSD bond length | 0.016 |
| RMSD bond angle | 1.945 |
| Data reduction software | XDS |
| Data scaling software | XDS |
| Phasing software | MOLREP |
| Refinement software | REFMAC (5.6.0117) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 43.100 | 1.800 |
| High resolution limit [Å] | 1.700 | 1.700 |
| Rmerge | 0.110 | 0.150 |
| Number of reflections | 64934 | |
| <I/σ(I)> | 6.59 | 3 |
| Completeness [%] | 86.8 | 49.2 |
| Redundancy | 3.3 | 1.9 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | THE CRYSTALS OF NCR WERE GROWN BY THE SITTING DROP METHOD IN A BUFFER CONTAINING 15% PEG 8000, 0.1 M NA CACODYLATE, AND 0.2 M CA ACETATE, AT PH 6.5. 0.4 MICRO L DIOXAN (30%) AND 0.4 MICRO L ISOPROPANOL WERE ADDED TO THE MICRO L CRYSTALLIZATION DROPS. |
