3LH4
Crystal Structure of Sialostatin L2
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | APS BEAMLINE 22-BM |
Synchrotron site | APS |
Beamline | 22-BM |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2008-02-21 |
Detector | MARMOSAIC 225 mm CCD |
Wavelength(s) | 0.97902 |
Spacegroup name | I 2 3 |
Unit cell lengths | 95.451, 95.451, 95.451 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 19.480 - 1.800 |
R-factor | 0.17391 |
Rwork | 0.173 |
R-free | 0.19602 |
Structure solution method | MOLECULAR REPLACEMENT |
RMSD bond length | 0.011 |
RMSD bond angle | 1.394 |
Data reduction software | HKL-2000 |
Data scaling software | HKL-2000 |
Phasing software | PHASER |
Refinement software | REFMAC (5.5.0102) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 19.480 | 1.860 |
High resolution limit [Å] | 1.800 | 1.800 |
Rmerge | 0.095 | 0.195 |
Number of reflections | 13472 | |
<I/σ(I)> | 22.1 | 26.6 |
Completeness [%] | 99.8 | 100 |
Redundancy | 29.9 | 28 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 9 | 298 | 1.8 M Ammonium sulfate, 0.1 M Bicine, pH 9.0, VAPOR DIFFUSION, HANGING DROP, temperature 298K |