2EKC
Structural study of Project ID aq_1548 from Aquifex aeolicus VF5
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SPRING-8 BEAMLINE BL26B1 |
| Synchrotron site | SPring-8 |
| Beamline | BL26B1 |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2006-12-11 |
| Detector | RIGAKU JUPITER 210 |
| Wavelength(s) | 1.0 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 57.854, 72.985, 64.942 |
| Unit cell angles | 90.00, 90.70, 90.00 |
Refinement procedure
| Resolution | 29.670 - 2.000 |
| R-factor | 0.186 |
| Rwork | 0.184 |
| R-free | 0.22000 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.005 |
| RMSD bond angle | 1.200 |
| Data reduction software | HKL-2000 |
| Data scaling software | SCALEPACK |
| Phasing software | MOLREP |
| Refinement software | CNS (1.1) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 30.000 | 2.070 |
| High resolution limit [Å] | 2.000 | 2.000 |
| Rmerge | 0.078 | 0.228 |
| Number of reflections | 36575 | |
| <I/σ(I)> | 10 | 4.17 |
| Completeness [%] | 99.7 | 99.8 |
| Redundancy | 3.6 | 3.5 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | MICROBATCH | 6.1 | 291 | 30v/v(%) PEG 200, 0.1M MES, 5w/v(%) PEG 3K, pH 6.1, MICROBATCH, temperature 291K |
