5UME
Crystal Structure of 5,10-Methylenetetrahydrofolate Reductase MetF from Haemophilus influenzae
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | APS BEAMLINE 19-ID |
| Synchrotron site | APS |
| Beamline | 19-ID |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2016-11-29 |
| Detector | DECTRIS PILATUS3 6M |
| Wavelength(s) | 0.97914 |
| Spacegroup name | P 21 21 21 |
| Unit cell lengths | 90.065, 134.960, 182.985 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 43.728 - 2.700 |
| R-factor | 0.1721 |
| Rwork | 0.169 |
| R-free | 0.22840 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 3fst |
| RMSD bond length | 0.008 |
| RMSD bond angle | 1.004 |
| Data reduction software | HKL-3000 |
| Data scaling software | HKL-3000 |
| Phasing software | HKL-3000 |
| Refinement software | PHENIX (1.11.1_2575) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 43.728 | 2.750 |
| High resolution limit [Å] | 2.700 | 2.700 |
| Number of reflections | 61981 | 2984 |
| <I/σ(I)> | 17.04 | 1.2 |
| Completeness [%] | 98.6 | 95.8 |
| Redundancy | 7.1 | 6.2 |
| CC(1/2) | 0.667 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 8 | 289 | 0.2 M calcium acetate, 0.1M 0.1 M imidazole, pH 8.0, 20 %(w/v) PEG1000 |
