1JZK
Crystal Structure of Scapharca inaequivalvis HbI, I114F mutant (deoxy)
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | ROTATING ANODE |
| Source details | RIGAKU RU200 |
| Temperature [K] | 296 |
| Detector technology | IMAGE PLATE |
| Collection date | 2001-02-23 |
| Detector | RIGAKU RAXIS IIC |
| Wavelength(s) | 1.5418 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 83.720, 44.180, 87.230 |
| Unit cell angles | 90.00, 115.49, 90.00 |
Refinement procedure
| Resolution | 37.690 - 2.200 |
| R-factor | 0.179 |
| Rwork | 0.179 |
| R-free | 0.21400 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 4sdh |
| RMSD bond length | 0.007 |
| RMSD bond angle | 1.400 |
| Data reduction software | DENZO |
| Data scaling software | SCALEPACK |
| Phasing software | CNS |
| Refinement software | CNS |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 40.000 | 2.280 |
| High resolution limit [Å] | 2.200 | 2.200 |
| Rmerge | 0.093 | 0.173 |
| Number of reflections | 28828 | |
| <I/σ(I)> | 11.2 | |
| Completeness [%] | 97.2 | 81.4 |
| Redundancy | 3.8 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | MICROBATCH | 7.5 | 296 | 2.1-2.3M Phosphate buffer, pH 7.5, Microbatch, temperature 296K |
