3D29
Proteasome Inhibition by Fellutamide B
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SLS BEAMLINE X06SA |
Synchrotron site | SLS |
Beamline | X06SA |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2006-04-28 |
Detector | PSI PILATUS 6M |
Wavelength(s) | 1.0 |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 134.272, 301.580, 143.454 |
Unit cell angles | 90.00, 112.70, 90.00 |
Refinement procedure
Resolution | 15.000 - 2.600 |
R-factor | 0.24 |
Rwork | 0.240 |
R-free | 0.26600 |
Structure solution method | FOURIER SYNTHESIS |
Starting model (for MR) | 1ryp |
RMSD bond length | 0.007 |
RMSD bond angle | 1.400 |
Data reduction software | XDS |
Data scaling software | XDS |
Phasing software | CNS |
Refinement software | CNS (1.1) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 40.000 | 2.630 |
High resolution limit [Å] | 2.600 | 2.600 |
Rmerge | 0.066 | 0.485 |
Number of reflections | 336246 | |
<I/σ(I)> | 2.7 | |
Completeness [%] | 98.7 | 99.2 |
Redundancy | 2.4 | 1.6 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 298 | 10 % MPD; 0,1 M MES, 30 mM MgAc2, pH 6,8, VAPOR DIFFUSION, HANGING DROP, temperature 298K |