3QJE
Human Hemoglobin A Mutant Beta H63L Deoxy-Form
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | ROTATING ANODE |
| Source details | RIGAKU RUH3R |
| Temperature [K] | 100 |
| Detector technology | IMAGE PLATE |
| Collection date | 2009-05-16 |
| Detector | RIGAKU RAXIS IV++ |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 62.420, 81.380, 53.520 |
| Unit cell angles | 90.00, 99.56, 90.00 |
Refinement procedure
| Resolution | 38.584 - 1.800 |
| R-factor | 0.2012 |
| Rwork | 0.199 |
| R-free | 0.24340 |
| Structure solution method | FOURIER SYNTHESIS |
| Starting model (for MR) | 2dn2 |
| RMSD bond length | 0.007 |
| RMSD bond angle | 1.223 |
| Data reduction software | d*TREK |
| Data scaling software | d*TREK |
| Phasing software | PHENIX |
| Refinement software | PHENIX ((phenix.refine: 1.6.4_486)) |
Data quality characteristics
| Overall | Inner shell | Outer shell | |
| Low resolution limit [Å] | 38.584 | 38.580 | 1.860 |
| High resolution limit [Å] | 1.800 | 3.880 | 1.800 |
| Number of reflections | 41952 | ||
| <I/σ(I)> | 12 | 2.4 | |
| Completeness [%] | 85.8 | 98.1 | 81.9 |
| Redundancy | 5.18 | 5.43 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | SMALL TUBES | 6.5 | 293 | 2.4-2.6 M ammonium phosphate/sulfate, pH 6.5, SMALL TUBES, temperature 293K |
