Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | ESRF BEAMLINE BM14 |
| Synchrotron site | ESRF |
| Beamline | BM14 |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2012-11-21 |
| Detector | MARMOSAIC 225 mm CCD |
| Wavelength(s) | 0.72932 |
| Spacegroup name | P 32 2 1 |
| Unit cell lengths | 47.971, 47.971, 82.473 |
| Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
| Resolution | 23.985 - 0.949 |
| R-factor | 0.1042 |
| Rwork | 0.104 |
| R-free | 0.11090 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 4hjm |
| RMSD bond length | 0.010 |
| RMSD bond angle | 1.475 |
| Data reduction software | HKL-2000 |
| Data scaling software | HKL-2000 |
| Phasing software | MOLREP |
| Refinement software | PHENIX (1.8.1_1168) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 50.000 | 0.970 |
| High resolution limit [Å] | 0.949 | 0.949 |
| Rmerge | 0.061 | 0.493 |
| Number of reflections | 69290 | |
| <I/σ(I)> | 43.02 | 6.7 |
| Completeness [%] | 98.7 | 100 |
| Redundancy | 21 | 21.5 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 7.5 | 293 | 12.5% w/v PEG1000, 12.5% w/v PEG3350, 12.5% v/v MPD, 0.02 M amino acids, 0.1 M MOPS/HEPES sodium, pH 7.5, VAPOR DIFFUSION, HANGING DROP, temperature 293K |
