5H9K
Crystal of a leukotriene-binding salivary lipocalin
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 | 2014-03-14 |
| Detector | RAYONIX MX300-HS |
| Wavelength(s) | 1.0000 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 35.130, 58.700, 35.480 |
| Unit cell angles | 90.00, 111.78, 90.00 |
Refinement procedure
| Resolution | 32.947 - 1.352 |
| R-factor | 0.1614 |
| Rwork | 0.160 |
| R-free | 0.18010 |
| Structure solution method | FOURIER SYNTHESIS |
| RMSD bond length | 0.006 |
| RMSD bond angle | 1.085 |
| Data scaling software | XSCALE |
| Phasing software | PHASER |
| Refinement software | PHENIX |
Data quality characteristics
| Overall | Inner shell | Outer shell | |
| Low resolution limit [Å] | 33.000 | 1.390 | |
| High resolution limit [Å] | 1.350 | 6.050 | 1.350 |
| Rmerge | 0.035 | 0.028 | 0.121 |
| Rmeas | 0.039 | 0.032 | 0.136 |
| Total number of observations | 152423 | ||
| Number of reflections | 28694 | 342 | 1999 |
| <I/σ(I)> | 30.48 | 50.04 | 10.69 |
| Completeness [%] | 97.7 | 96.9 | 92.8 |
| Redundancy | 5.3 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 298 | 0.1 M Tris pH 8.0, 30 % PEG 6000 |
