5V3T
Crystal Structure of the Group II Truncated Hemoglobin from Bacillus Anthracis
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | ROTATING ANODE |
| Source details | RIGAKU RUH3R |
| Temperature [K] | 100 |
| Detector technology | IMAGE PLATE |
| Collection date | 2012-06-12 |
| Detector | RIGAKU RAXIS IV |
| Wavelength(s) | 1.54 |
| Spacegroup name | C 2 2 21 |
| Unit cell lengths | 49.770, 122.170, 112.560 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 56.280 - 1.899 |
| R-factor | 0.1923 |
| Rwork | 0.190 |
| R-free | 0.21810 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 1ux8 |
| RMSD bond length | 0.009 |
| RMSD bond angle | 1.138 |
| Data reduction software | d*TREK (9.9.3L) |
| Data scaling software | d*TREK |
| Phasing software | PHENIX |
| Refinement software | PHENIX |
Data quality characteristics
| Overall | Inner shell | Outer shell | |
| Low resolution limit [Å] | 56.280 | 56.280 | 1.970 |
| High resolution limit [Å] | 1.899 | 4.090 | 1.900 |
| Rmerge | 0.049 | 0.040 | 0.196 |
| Number of reflections | 24994 | ||
| <I/σ(I)> | 13.4 | 42.3 | 4.3 |
| Completeness [%] | 90.8 | 97.7 | 92.3 |
| Redundancy | 3.15 | 3.04 | 3.28 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 298 | 2.5 M Ammonium sulphate |
