5NHM
Crystal structure of apo xylose isomerase from Piromyces E2
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | ROTATING ANODE |
| Source details | BRUKER AXS MICROSTAR-H |
| Temperature [K] | 110 |
| Detector technology | IMAGE PLATE |
| Collection date | 2014-08-25 |
| Detector | MARRESEARCH |
| Wavelength(s) | 1.5418 |
| Spacegroup name | P 1 |
| Unit cell lengths | 78.931, 79.286, 91.106 |
| Unit cell angles | 115.77, 89.50, 116.73 |
Refinement procedure
| Resolution | 59.000 - 1.670 |
| R-factor | 0.18504 |
| Rwork | 0.184 |
| R-free | 0.21005 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | D_1200004044 |
| RMSD bond length | 0.009 |
| RMSD bond angle | 1.312 |
| Data reduction software | iMOSFLM |
| Data scaling software | Aimless |
| Phasing software | PHASER |
| Refinement software | REFMAC (5.8.0073) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 59.000 | 1.700 |
| High resolution limit [Å] | 1.670 | 1.670 |
| Rmerge | 0.078 | 0.286 |
| Rpim | 0.054 | 0.206 |
| Number of reflections | 187268 | 8864 |
| <I/σ(I)> | 9.1 | 3.7 |
| Completeness [%] | 93.3 | 88.9 |
| Redundancy | 4 | 3.8 |
| CC(1/2) | 0.995 | 0.840 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION | 7 | 294 | 13-15 % PEG3350, Hepes buffer pH 7 |
