9GT2
DTPAA CHIP EXPERIMENT, ID29, X,Y SPACING 50,50
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | ESRF BEAMLINE ID29 |
| Synchrotron site | ESRF |
| Beamline | ID29 |
| Temperature [K] | 293 |
| Detector technology | PIXEL |
| Collection date | 2024-01-01 |
| Detector | PSI JUNGFRAU 4M |
| Wavelength(s) | 1.073 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 73.600, 68.800, 75.600 |
| Unit cell angles | 90.00, 105.80, 90.00 |
Refinement procedure
| Resolution | 37.680 - 1.600 |
| R-factor | 0.13736 |
| Rwork | 0.136 |
| R-free | 0.15881 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.012 |
| RMSD bond angle | 1.835 |
| Data reduction software | CrystFEL |
| Data scaling software | CrystFEL |
| Phasing software | PHASER |
| Refinement software | REFMAC (5.8.0258) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 40.000 | 1.640 |
| High resolution limit [Å] | 1.600 | 1.600 |
| Number of reflections | 95797 | 4789 |
| <I/σ(I)> | 11.3 | 1.5 |
| Completeness [%] | 100.0 | |
| Redundancy | 1522 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | BATCH MODE | 293 | PEG 6K, HEPES 7.0 |
