3OQI
Crystal structure of B. licheniformis CDPS yvmC-BLIC in complex with CHES
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SPRING-8 BEAMLINE BL41XU |
| Synchrotron site | SPring-8 |
| Beamline | BL41XU |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2010-06-19 |
| Detector | RAYONIX MX225HE |
| Wavelength(s) | 1.0 |
| Spacegroup name | C 1 2 1 |
| Unit cell lengths | 150.946, 55.011, 102.299 |
| Unit cell angles | 90.00, 130.61, 90.00 |
Refinement procedure
| Resolution | 32.354 - 1.701 |
| R-factor | 0.1658 |
| Rwork | 0.165 |
| R-free | 0.18360 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.006 |
| RMSD bond angle | 1.060 |
| Data reduction software | DENZO |
| Data scaling software | SCALEPACK |
| Phasing software | PHASER (2.2.4) |
| Refinement software | PHENIX (1.6.2_432) |
Data quality characteristics
| Overall | Inner shell | Outer shell | |
| Low resolution limit [Å] | 50.000 | 50.000 | 1.760 |
| High resolution limit [Å] | 1.700 | 3.660 | 1.700 |
| Rmerge | 0.085 | 0.033 | 0.566 |
| Number of reflections | 70129 | ||
| <I/σ(I)> | 8.8 | ||
| Completeness [%] | 100.0 | 99.8 | 100 |
| Redundancy | 7.5 | 7.4 | 7.5 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 9.5 | 293 | 20% PEG 8000, pH 9.5, vapor diffusion, hanging drop, temperature 293K |
