3GVE
Crystal structure of calcineurin-like phosphoesterase YfkN from Bacillus subtilis
Experimental procedure
| Experimental method | SAD |
| Source type | SYNCHROTRON |
| Source details | APS BEAMLINE 19-ID |
| Synchrotron site | APS |
| Beamline | 19-ID |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2009-02-13 |
| Detector | ADSC QUANTUM 315r |
| Wavelength(s) | 0.97937 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 67.091, 92.505, 50.316 |
| Unit cell angles | 90.00, 89.94, 90.00 |
Refinement procedure
| Resolution | 31.536 - 1.250 |
| R-factor | 0.154 |
| Rwork | 0.154 |
| R-free | 0.16300 |
| Structure solution method | SAD |
| RMSD bond length | 0.018 |
| RMSD bond angle | 1.508 |
| Data reduction software | HKL-3000 |
| Data scaling software | HKL-3000 |
| Phasing software | HKL-3000 |
| Refinement software | PHENIX |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 31.536 | 1.270 |
| High resolution limit [Å] | 1.250 | 1.250 |
| Rmerge | 0.116 | 0.686 |
| Number of reflections | 169020 | |
| <I/σ(I)> | 8.5 | 2.9 |
| Completeness [%] | 99.8 | 98.7 |
| Redundancy | 9.1 | 7.7 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 7.5 | 277 | 0.1 M HEPES pH 7.5, 1.4 M Sodium citrate tribasic dihydrate, VAPOR DIFFUSION, SITTING DROP, temperature 277K |
