1C7C
DEOXY RHB1.1 (RECOMBINANT HEMOGLOBIN)
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | ROTATING ANODE |
| Source details | SIEMENS |
| Temperature [K] | 295 |
| Detector technology | IMAGE PLATE |
| Collection date | 1998-06-15 |
| Detector | RIGAKU RAXIS IIC |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 63.204, 83.357, 54.003 |
| Unit cell angles | 90.00, 99.07, 90.00 |
Refinement procedure
| Resolution | 8.000 - 1.800 |
| R-factor | 0.176 * |
| R-free | 0.22700 * |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 1aby |
| RMSD bond length | 0.005 |
| RMSD bond angle | 0.016 |
| Data reduction software | XDS |
| Data scaling software | XSCALE |
| Phasing software | CNS |
| Refinement software | SHELXL-97 |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 30.000 | 1.900 |
| High resolution limit [Å] | 1.800 | 1.800 |
| Rmerge | 0.049 | 0.247 |
| Total number of observations | 143808 * | |
| Number of reflections | 45597 | |
| <I/σ(I)> | 33.3 | 9.26 |
| Completeness [%] | 89.0 | 94.1 |
| Redundancy | 3.2 * | 3.2 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | Batch method * | 7 * | PERUTZ, J.CRYST.GROWTH 2(1968)54-56, pH 6.5 |
Crystallization Reagents in Literatures
| ID | crystal ID | solution | reagent name | concentration (unit) | details |
| 1 | 1 | 1 | ammonium phosphate | 10 (mM) |
