5O18
Crystal structure of murine neuroglobin mutant V140W
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | ESRF BEAMLINE BM16 |
| Synchrotron site | ESRF |
| Beamline | BM16 |
| Temperature [K] | 293 |
| Detector technology | CCD |
| Collection date | 2011-02-20 |
| Detector | ADSC QUANTUM 210r |
| Wavelength(s) | 0.980 |
| Spacegroup name | H 3 2 |
| Unit cell lengths | 88.563, 88.563, 116.210 |
| Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
| Resolution | 20.000 - 1.860 |
| R-factor | 0.1808 |
| Rwork | 0.179 |
| R-free | 0.22180 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 1q1f |
| RMSD bond length | 0.020 |
| RMSD bond angle | 1.975 |
| Data reduction software | XDS |
| Data scaling software | SCALA (6.1) |
| Phasing software | PHASER (2.3.0) |
| Refinement software | REFMAC (5.8.0135) |
Data quality characteristics
| Overall | Inner shell | Outer shell | |
| Low resolution limit [Å] | 23.157 | 23.157 | 1.960 |
| High resolution limit [Å] | 1.858 | 5.880 | 1.860 |
| Rmerge | 0.025 | 0.644 | |
| Rmeas | 0.060 | 0.028 | 0.727 |
| Rpim | 0.022 | 0.011 | 0.324 |
| Number of reflections | 14557 | ||
| <I/σ(I)> | 18.9 | 20.1 | 1.2 |
| Completeness [%] | 97.5 | 94.1 | 88.8 |
| Redundancy | 7 | 7 | 4.3 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 6.5 | 293 | 1.6 M ammonium sulfate, 0.1 M MES, 10 % dioxane |
