1XQ5
Met-Perch Hemoglobin at 1.9A
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | APS BEAMLINE 19-BM |
| Synchrotron site | APS |
| Beamline | 19-BM |
| Temperature [K] | 110 |
| Detector technology | CCD |
| Collection date | 2004-07-31 |
| Detector | APS-1 |
| Wavelength(s) | 0.97934 |
| Spacegroup name | P 21 21 21 |
| Unit cell lengths | 57.302, 84.986, 121.779 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 69.010 - 1.900 |
| R-factor | 0.24573 |
| Rwork | 0.243 |
| R-free | 0.29717 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 1ouu |
| RMSD bond length | 0.018 |
| RMSD bond angle | 1.809 |
| Data reduction software | HKL-2000 |
| Data scaling software | SCALEPACK |
| Phasing software | AMoRE |
| Refinement software | REFMAC (5.2.0005) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 69.007 | 1.970 |
| High resolution limit [Å] | 1.898 | 1.900 |
| Rmerge | 0.084 | 0.521 |
| Number of reflections | 43714 | |
| <I/σ(I)> | 15.096 | 4.027 |
| Completeness [%] | 96.3 | 96.1 |
| Redundancy | 6.5 | 5.9 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | Batch | 7 | 296 | PEG 4K, Hepes, pH 7.0, Batch, temperature 296K |
