3DJA
Crystal Structure of cpaf solved with MAD
Experimental procedure
| Experimental method | MAD |
| Source type | SYNCHROTRON |
| Source details | BSRF BEAMLINE 3W1A |
| Synchrotron site | BSRF |
| Beamline | 3W1A |
| Temperature [K] | 95 |
| Detector technology | CCD |
| Detector | MAR CCD 165 mm |
| Wavelength(s) | 0.9641, 0.9792, 0.9793 |
| Spacegroup name | P 41 21 2 |
| Unit cell lengths | 124.870, 124.870, 241.520 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 20.000 - 2.900 |
| R-factor | 0.2453 |
| Rwork | 0.245 |
| R-free | 0.28990 |
| Structure solution method | MAD |
| RMSD bond length | 0.008 |
| RMSD bond angle | 1.501 |
| Data reduction software | HKL-2000 |
| Data scaling software | HKL-2000 |
| Phasing software | SOLVE |
| Refinement software | CNS (1.1) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 50.000 | 2.680 |
| High resolution limit [Å] | 2.590 | 2.590 |
| Rmerge | 0.079 | 0.725 |
| Number of reflections | 60232 | |
| <I/σ(I)> | 30.6 | 3.2 |
| Completeness [%] | 100.0 | 100 |
| Redundancy | 10.4 | 9 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 7.5 | 293 | 0.75M Li2SO4, 0.1M Na Hepes pH 7.5, VAPOR DIFFUSION, HANGING DROP, temperature 293K |
