Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | NSLS BEAMLINE X29A |
| Synchrotron site | NSLS |
| Beamline | X29A |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2008-04-11 |
| Detector | ADSC QUANTUM 315 |
| Wavelength(s) | 1.0809 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 64.477, 38.124, 80.658 |
| Unit cell angles | 90.00, 98.71, 90.00 |
Refinement procedure
| Resolution | 16.000 - 1.600 |
| R-factor | 0.219 |
| Rwork | 0.218 |
| R-free | 0.25100 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 2fjt |
| RMSD bond length | 0.018 |
| RMSD bond angle | 1.804 |
| Data reduction software | DENZO |
| Data scaling software | SCALEPACK |
| Phasing software | PHASER (1.3.2) |
| Refinement software | REFMAC |
Data quality characteristics
| Overall | Inner shell | Outer shell | |
| Low resolution limit [Å] | 30.000 | 30.000 | 1.660 |
| High resolution limit [Å] | 1.600 | 3.450 | 1.600 |
| Rmerge | 0.060 | 0.046 | 0.431 |
| Number of reflections | 49467 | ||
| <I/σ(I)> | 14.1 | ||
| Completeness [%] | 95.5 | 97.8 | 62.9 |
| Redundancy | 6.4 | 6.8 | 2 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 5.6 | 298 | 45 MG/ML PTN, 7% PEG 5K MME, 0.1M AMS, 0.1M MES, PH 5.6, MACROSEEDING TO GROW BIG SINGLES, VAPOR DIFFUSION, HANGING DROP, temperature 298K |
