3LR9
X-ray photogenerated ferrous horse heart myoglobin, nitrite adduct
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | NSLS BEAMLINE X26C |
| Synchrotron site | NSLS |
| Beamline | X26C |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2009-09-26 |
| Detector | ADSC QUANTUM 4 |
| Wavelength(s) | 1.000 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 35.327, 28.691, 62.911 |
| Unit cell angles | 90.00, 105.64, 90.00 |
Refinement procedure
| Resolution | 26.740 - 1.550 |
| R-factor | 0.1803 |
| Rwork | 0.178 |
| R-free | 0.21180 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | : 1dwr |
| RMSD bond length | 0.006 |
| RMSD bond angle | 0.994 |
| Data reduction software | d*TREK |
| Data scaling software | d*TREK |
| Phasing software | PHASER |
| Refinement software | PHENIX ((phenix.refine: 1.5_2)) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 26.740 | 1.610 |
| High resolution limit [Å] | 1.550 | 1.550 |
| Rmerge | 0.042 | 0.186 |
| Number of reflections | 17892 | |
| <I/σ(I)> | 15.7 | 3.9 |
| Completeness [%] | 99.2 | 95.3 |
| Redundancy | 3.85 | 2.87 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | seeding | 7.4 | 295 | 2.74 M ammonium sulfate, 100 mM TrisHCl, 1 mM EDTA, pH 7.4, seeding, temperature 295K |
