4ARU
Hafnia Alvei phytase in complex with tartrate
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | ESRF BEAMLINE ID23-1 |
| Synchrotron site | ESRF |
| Beamline | ID23-1 |
| Temperature [K] | 120 |
| Detector technology | CCD |
| Detector | ADSC QUANTUM 315r |
| Spacegroup name | C 2 2 21 |
| Unit cell lengths | 101.055, 101.399, 84.946 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 54.800 - 1.450 |
| R-factor | 0.16306 |
| Rwork | 0.162 |
| R-free | 0.18865 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 4ars |
| RMSD bond length | 0.014 |
| RMSD bond angle | 1.631 |
| Phasing software | MOLREP |
| Refinement software | REFMAC (5.7.0032) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 54.760 | 1.530 |
| High resolution limit [Å] | 1.450 | 1.450 |
| Rmerge | 0.120 | 1.090 |
| Number of reflections | 77478 | |
| <I/σ(I)> | 13.9 | 2.5 |
| Completeness [%] | 99.9 | 100 |
| Redundancy | 13.2 | 11 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | 7.7MG/ML PROTEIN MIXED WITH MIHS AT 3:1 MOLAR RATIO; CONDITION H2 OF INDEX SCREEN, 0.2M POTASSIUM SODIUM TARTRATE; 20% PEG 3350 PH 8.5 |
