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 | MARRESEARCH |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 78.922, 96.651, 92.358 |
| Unit cell angles | 90.00, 99.60, 90.00 |
Refinement procedure
| Resolution | 50.000 - 1.600 |
| R-factor | 0.15 |
| Rwork | 0.149 |
| R-free | 0.17600 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | CPA4 WITHIN PCPA4 |
| RMSD bond length | 0.011 |
| RMSD bond angle | 1.348 |
| Data scaling software | SCALA |
| Phasing software | AMoRE |
| Refinement software | REFMAC (5.1.9999) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 48.300 | 1.690 |
| High resolution limit [Å] | 1.600 | 1.600 |
| Rmerge | 0.070 | 0.260 |
| Number of reflections | 179401 | |
| <I/σ(I)> | 11.8 | 4.8 |
| Completeness [%] | 99.8 | 99.3 |
| Redundancy | 3.8 | 3.7 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | 6.5 | 40% MPD; 0.1M BIS-TRIS PH 6.5 |
