4UTW
Structural characterisation of NanE, ManNac6P C2 epimerase, from Clostridium perfingens
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | ESRF BEAMLINE ID23-1 |
| Synchrotron site | ESRF |
| Beamline | ID23-1 |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Detector | ADSC QUANTUM 210 |
| Spacegroup name | P 1 |
| Unit cell lengths | 36.756, 75.584, 82.173 |
| Unit cell angles | 89.90, 89.91, 92.92 |
Refinement procedure
| Resolution | 50.000 - 1.900 |
| R-factor | 0.18832 |
| Rwork | 0.185 |
| R-free | 0.24805 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 4utt |
| RMSD bond length | 0.017 |
| RMSD bond angle | 1.622 |
| Phasing software | MOLREP |
| Refinement software | REFMAC (5.5.0088) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 41.100 | 2.000 |
| High resolution limit [Å] | 1.900 | 1.900 |
| Rmerge | 0.080 | 0.420 |
| Number of reflections | 63357 | |
| <I/σ(I)> | 10 | 1.5 |
| Completeness [%] | 91.0 | 85.9 |
| Redundancy | 1.9 | 1.8 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | 0.1 M NA CACODYLATE PH 6.5, 0.2 M CA ACETATE, 24.5% (W/V) PEG 2K MME AND 5% (V/V) PEG 400 |
