4MHX
Crystal Structure of Sulfamidase
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SLS BEAMLINE X10SA |
Synchrotron site | SLS |
Beamline | X10SA |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2012-05-23 |
Detector | DECTRIS PILATUS 6M |
Wavelength(s) | 0.99989 |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 61.380, 107.900, 79.790 |
Unit cell angles | 90.00, 104.07, 90.00 |
Refinement procedure
Resolution | 44.300 - 2.000 |
R-factor | 0.1939 |
Rwork | 0.192 |
R-free | 0.22990 |
Structure solution method | MOLECULAR REPLACEMENT |
RMSD bond length | 0.013 |
RMSD bond angle | 1.564 |
Data reduction software | XDS |
Data scaling software | XSCALE |
Phasing software | PHASER (2.3.0) |
Refinement software | REFMAC |
Data quality characteristics
Overall | Inner shell | Outer shell | |
Low resolution limit [Å] | 2.040 | ||
High resolution limit [Å] | 1.990 | 8.910 | 1.990 |
Rmerge | 0.089 | 0.011 | 0.011 |
Number of reflections | 134186 | 1477 | 8986 |
<I/σ(I)> | 7.83 | 22.62 | 1.06 |
Completeness [%] | 98.7 | 97.1 | 88.8 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 7.5 | 293 | 25% (w/v) polyethylene glycol (PEG) 3350, 200 mM MgCl2 and 100 mM HEPES buffer, pH 7.5, VAPOR DIFFUSION, SITTING DROP, temperature 293K |