3WHL
Crystal structure of Nas2 N-terminal domain complexed with PAN-Rpt5C chimera
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SPRING-8 BEAMLINE BL44XU |
| Synchrotron site | SPring-8 |
| Beamline | BL44XU |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2012-01-30 |
| Detector | RAYONIX MX-225 |
| Wavelength(s) | 0.90000 |
| Spacegroup name | P 31 2 1 |
| Unit cell lengths | 110.630, 110.630, 251.940 |
| Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
| Resolution | 19.940 - 4.000 |
| R-factor | 0.235 |
| Rwork | 0.233 |
| R-free | 0.28500 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 3whk |
| RMSD bond length | 0.003 |
| RMSD bond angle | 0.876 |
| Data reduction software | DENZO |
| Data scaling software | SCALEPACK |
| Phasing software | MOLREP |
| Refinement software | PHENIX ((phenix.refine: 1.8_1069)) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 50.000 | 4.070 |
| High resolution limit [Å] | 4.000 | 4.000 |
| Rmerge | 0.100 | 0.554 |
| Number of reflections | 15849 | |
| <I/σ(I)> | 28.1 | 5 |
| Completeness [%] | 100.0 | 100 |
| Redundancy | 5.5 | 5.5 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 6 | 293 | 8% PEG 6000, 0.1M MES (pH6.0), 80mM MgCl2, VAPOR DIFFUSION, SITTING DROP, temperature 293K |
