4HWX
Crystal structure of Streptomyces caespitosus sermetstatin
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | ESRF BEAMLINE ID23-2 |
Synchrotron site | ESRF |
Beamline | ID23-2 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2009-10-06 |
Detector | MARMOSAIC 225 mm CCD |
Wavelength(s) | 0.8726 |
Spacegroup name | P 31 2 1 |
Unit cell lengths | 71.040, 71.040, 52.400 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 39.890 - 1.900 |
R-factor | 0.1883 |
Rwork | 0.187 |
R-free | 0.21400 |
Structure solution method | SAD |
RMSD bond length | 0.010 |
RMSD bond angle | 1.140 |
Data reduction software | XDS |
Data scaling software | SCALA |
Phasing software | SHELX (& PHASER) |
Refinement software | BUSTER (2.11.2) |
Data quality characteristics
Overall | |
Low resolution limit [Å] | 39.900 |
High resolution limit [Å] | 1.900 |
Rmerge | 0.038 |
Number of reflections | 12234 |
<I/σ(I)> | 40.3 |
Completeness [%] | 99.3 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 5.6 | 293 | 0.1 M sodium citrate dihydrate, 0.2 M ammonium acetate, 10% (w/v) PEG3350, pH 5.6, VAPOR DIFFUSION, SITTING DROP, temperature 293K |