4UME
Crystal structure of 3-deoxy-D-manno-octulosonate 8-phosphate phosphatase from Moraxella catarrhalis in complex with Magnesium ion and KDO molecule
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | ROTATING ANODE |
| Source details | BRUKER AXS MICROSTAR-H |
| Temperature [K] | 100 |
| Detector technology | IMAGE PLATE |
| Collection date | 2013-05-10 |
| Detector | MARRESEARCH |
| Spacegroup name | I 4 |
| Unit cell lengths | 86.610, 86.610, 41.400 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 37.380 - 2.090 |
| R-factor | 0.19314 |
| Rwork | 0.190 |
| R-free | 0.25844 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 3n1u |
| RMSD bond length | 0.007 |
| RMSD bond angle | 1.259 |
| Data reduction software | MOSFLM |
| Data scaling software | SCALA |
| Phasing software | MOLREP |
| Refinement software | REFMAC (5.7.0032) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 43.310 | 2.180 |
| High resolution limit [Å] | 2.070 | 2.070 |
| Rmerge | 0.180 | 0.410 |
| Number of reflections | 9166 | |
| <I/σ(I)> | 7.8 | 4 |
| Completeness [%] | 96.2 | 77.4 |
| Redundancy | 4.9 | 4.4 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | 7 | 100 MM MG FORMATE, 100 MM BIS-TRIS PROPANE (PH 5.0), 28% W/V PEG 3350, KDO, NA PHOSPHATE |
