5CWM
Crystal structure of de novo designed helical repeat protein DHR64
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 | 2015-01-16 |
Detector | ADSC QUANTUM 315r |
Wavelength(s) | 1.111 |
Spacegroup name | P 65 |
Unit cell lengths | 98.280, 98.280, 48.570 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 49.140 - 2.900 |
R-factor | 0.2175 |
Rwork | 0.216 |
R-free | 0.24690 |
Structure solution method | MOLECULAR REPLACEMENT |
RMSD bond length | 0.002 |
RMSD bond angle | 0.419 |
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 | 2.980 | |
High resolution limit [Å] | 2.900 | 12.970 | 2.900 |
Rmerge | 0.152 | 0.032 | 2.138 |
Rmeas | 0.159 | 0.034 | 2.239 |
Total number of observations | 67571 | ||
Number of reflections | 6086 | 81 | 448 |
<I/σ(I)> | 14.38 | 56.3 | 1.34 |
Completeness [%] | 100.0 | 98.8 | 100 |
Redundancy | 11.1 | 11.3 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 5 | 293 | 0.1 M Sodium acetate, pH 5.0, 10% (v/v) MPD |