5MLY
Closed loop conformation of PhaZ7 Y105E mutant
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | EMBL/DESY, HAMBURG BEAMLINE X13 |
| Synchrotron site | EMBL/DESY, HAMBURG |
| Beamline | X13 |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2010-04-09 |
| Detector | MARRESEARCH |
| Wavelength(s) | 0.8123 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 41.410, 199.760, 43.960 |
| Unit cell angles | 90.00, 114.17, 90.00 |
Refinement procedure
| Resolution | 19.400 - 1.598 |
| R-factor | 0.1295 |
| Rwork | 0.128 |
| R-free | 0.15660 |
| Structure solution method | FOURIER SYNTHESIS |
| Starting model (for MR) | 4brs |
| RMSD bond length | 0.008 |
| RMSD bond angle | 0.878 |
| Data reduction software | XDS |
| Data scaling software | XDS |
| Phasing software | PHENIX |
| Refinement software | PHENIX ((1.11.1_2575: ???)) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 19.400 | 1.640 |
| High resolution limit [Å] | 1.598 | 1.598 |
| Rmerge | 0.140 | |
| Number of reflections | 78330 | |
| <I/σ(I)> | 25.8 | 4.8 |
| Completeness [%] | 91.3 | 77.9 |
| Redundancy | 1.8 | 1.7 |
| CC(1/2) | 0.999 | 0.938 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 6 | 289 | 0.2 M NaCl, 0.1 M MES, 20% PEG6000 |
