5CWD
Crystal structure of de novo designed helical repeat protein DHR7
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | ALS BEAMLINE 8.3.1 |
| Synchrotron site | ALS |
| Beamline | 8.3.1 |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2014-03-10 |
| Detector | ADSC QUANTUM 315r |
| Wavelength(s) | 1.111 |
| Spacegroup name | C 1 2 1 |
| Unit cell lengths | 84.881, 29.449, 63.432 |
| Unit cell angles | 90.00, 123.51, 90.00 |
Refinement procedure
| Resolution | 42.029 - 2.610 |
| R-factor | 0.2613 |
| Rwork | 0.259 |
| R-free | 0.30600 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.003 |
| RMSD bond angle | 0.531 |
| Data reduction software | XDS |
| Data scaling software | XSCALE |
| Phasing software | PHASER |
| Refinement software | PHENIX ((phenix.refine: 1.9_1692)) |
Data quality characteristics
| Overall | Inner shell | Outer shell | |
| Low resolution limit [Å] | 50.000 | 2.670 | |
| High resolution limit [Å] | 2.600 | 11.630 | 2.600 |
| Rmerge | 0.152 | 0.059 | 0.812 |
| Rmeas | 0.181 | 0.073 | 0.964 |
| Total number of observations | 13960 | ||
| Number of reflections | 4124 | 53 | 322 |
| <I/σ(I)> | 4.88 | 9.66 | 1.21 |
| Completeness [%] | 98.3 | 91.4 | 97.9 |
| Redundancy | 3.4 | 3.4 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 9.5 | 293 | 0.2 M Sodium chloride, 0.1 M CHES, pH 9.5, 50% (v/v) PEG 400 |
