3QZZ
3D Structure of Ferric Methanosarcina Acetivorans Protoglobin Y61W mutant in Aquomet form
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | ESRF BEAMLINE ID23-1 |
| Synchrotron site | ESRF |
| Beamline | ID23-1 |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2007-09-28 |
| Detector | ADSC QUANTUM 315r |
| Spacegroup name | C 1 2 1 |
| Unit cell lengths | 81.296, 48.730, 50.925 |
| Unit cell angles | 90.00, 101.10, 90.00 |
Refinement procedure
| Resolution | 39.890 - 2.400 |
| R-factor | 0.24132 |
| Rwork | 0.238 |
| R-free | 0.30592 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.007 |
| RMSD bond angle | 1.009 |
| Data reduction software | MOSFLM |
| Data scaling software | SCALA |
| Phasing software | PHASER |
| Refinement software | REFMAC (5.5.0072) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 50.000 | 2.530 |
| High resolution limit [Å] | 2.400 | 2.400 |
| Rmerge | 0.143 | 0.316 |
| Number of reflections | 7554 | |
| <I/σ(I)> | 7.1 | 2.8 |
| Completeness [%] | 97.1 | 98.3 |
| Redundancy | 2.5 | 2.5 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION | 7.5 | 277 | 0.4 MONOBASIC AMMONIUM PHOSPHATE, pH 7.5, VAPOR DIFFUSION, temperature 277K |
