4A1I
ykud from B.subtilis
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | ESRF BEAMLINE ID29 |
| Synchrotron site | ESRF |
| Beamline | ID29 |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Detector | ADSC QUANTUM 315r |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 55.450, 91.850, 123.700 |
| Unit cell angles | 90.00, 90.25, 90.00 |
Refinement procedure
| Resolution | 51.302 - 1.760 |
| R-factor | 0.1737 |
| Rwork | 0.173 |
| R-free | 0.21810 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 1y7m |
| RMSD bond length | 0.005 |
| RMSD bond angle | 0.920 |
| Phasing software | PHASER |
| Refinement software | PHENIX ((PHENIX.REFINE)) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 123.000 | 1.800 |
| High resolution limit [Å] | 1.760 | 1.760 |
| Rmerge | 0.110 | 0.660 |
| Number of reflections | 120001 | |
| <I/σ(I)> | 10.1 | 2.42 |
| Completeness [%] | 92.0 | 96.4 |
| Redundancy | 2.15 | 2.11 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | 100 MM MES PH 6.0, 150 MM LISO4, 30% PEG 5000, 10MM CDCL2 AND 0.5 MM N-ACETYL-CHITOPENTAOSE. |
