5D1V
Crystal Structure and Thermal Stability of Hemoglobin from Thermophilic Phototrophic Bacterium Chloroflexus aurantiacus
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | APS BEAMLINE 19-BM |
| Synchrotron site | APS |
| Beamline | 19-BM |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2014-12-11 |
| Detector | ADSC QUANTUM 210r |
| Wavelength(s) | 1.0 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 46.960, 41.298, 72.117 |
| Unit cell angles | 90.00, 107.70, 90.00 |
Refinement procedure
| Resolution | 19.590 - 1.740 |
| R-factor | 0.1514 |
| Rwork | 0.149 |
| R-free | 0.18720 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.011 |
| RMSD bond angle | 1.308 |
| Data reduction software | XDS |
| Data scaling software | Aimless |
| Phasing software | PHASER |
| Refinement software | PHENIX (dev_1938) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 19.590 | 1.802 |
| High resolution limit [Å] | 1.740 | 1.740 |
| Rmerge | 0.034 | 0.161 |
| Number of reflections | 27141 | |
| <I/σ(I)> | 26.6 | 6.49 |
| Completeness [%] | 99.0 | 99 |
| Redundancy | 3.5 | 2.8 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 7 | 293 | 200 mM ammonium fluoride 20-30 mM HEPES pH 7.0 16-20 % PEG 3350 |
