3EX9
Crystal structure of PhzA/B from Burkholderia cepacia R18194 crystallized in C2221
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SLS BEAMLINE X10SA |
| Synchrotron site | SLS |
| Beamline | X10SA |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2008-07-20 |
| Detector | MARMOSAIC 225 mm CCD |
| Wavelength(s) | 1.0 |
| Spacegroup name | C 2 2 21 |
| Unit cell lengths | 78.940, 79.680, 64.240 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 20.000 - 2.200 |
| R-factor | 0.19476 |
| Rwork | 0.192 |
| R-free | 0.23968 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 3b4o |
| RMSD bond length | 0.022 |
| RMSD bond angle | 1.831 |
| Data reduction software | XDS |
| Data scaling software | XSCALE |
| Phasing software | MOLREP |
| Refinement software | REFMAC (5.2.0019) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 42.260 | 2.300 |
| High resolution limit [Å] | 2.200 | 2.100 |
| Rmerge | 0.429 | |
| Number of reflections | 10338 | |
| <I/σ(I)> | 20.1 | 5.5 |
| Completeness [%] | 97.4 | 95.7 |
| Redundancy | 9.2 | 8.6 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 6.2 | 284 | 0.1M Bis-TRIS, 0.2M NH4OAc, 20% (w/v) PEG 3350, pH 6.2, VAPOR DIFFUSION, HANGING DROP, temperature 284K |
