3DDR
Structure of the Serratia marcescens hemophore receptor HasR-Ile671Gly mutant in complex with its hemophore HasA and heme
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 | 2008-05-05 |
| Detector | PSI PILATUS 6M |
| Spacegroup name | F 2 2 2 |
| Unit cell lengths | 157.410, 162.720, 597.010 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 39.250 - 2.800 |
| R-factor | 0.227 |
| Rwork | 0.226 |
| R-free | 0.26200 |
| Structure solution method | Difference fourier |
| RMSD bond length | 0.006 |
| RMSD bond angle | 1.078 |
| Data reduction software | XDS |
| Data scaling software | XSCALE |
| Phasing software | PHENIX |
| Refinement software | PHENIX ((phenix.refine)) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 39.400 | 2.960 |
| High resolution limit [Å] | 2.800 | 2.800 |
| Rmerge | 0.200 | 0.198 |
| Number of reflections | 92482 | |
| <I/σ(I)> | 14.03 | 0.89 |
| Completeness [%] | 98.0 | 88.3 |
| Redundancy | 6.66 | 5.55 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | 8 | 291 | 2 M NaCl, 100 mM Tris, pH 8.0, VAPOR DIFFUSION, HANGING DROP, temperature 291K |
