6XRI
MSMEG_2027 domain-swapped dimer
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | AUSTRALIAN SYNCHROTRON BEAMLINE MX1 |
| Synchrotron site | Australian Synchrotron |
| Beamline | MX1 |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2013-10-17 |
| Detector | ADSC QUANTUM 210r |
| Wavelength(s) | 0.9537 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 73.554, 110.228, 140.150 |
| Unit cell angles | 90.00, 105.21, 90.00 |
Refinement procedure
| Resolution | 34.180 - 2.370 |
| R-factor | 0.2494 |
| Rwork | 0.242 |
| R-free | 0.30090 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 4y9i |
| RMSD bond length | 0.009 |
| RMSD bond angle | 0.861 |
| Data reduction software | XDS (20200417) |
| Data scaling software | Aimless (0.7.4) |
| Phasing software | PHASER (5.8.0073) |
| Refinement software | PHENIX (1.18_3855) |
Data quality characteristics
| Overall | Inner shell | Outer shell | |
| Low resolution limit [Å] | 34.210 | 34.210 | 2.420 |
| High resolution limit [Å] | 2.370 | 12.310 | 2.370 |
| Rmerge | 0.205 | 0.031 | 1.703 |
| Rmeas | 0.239 | 0.037 | 1.981 |
| Rpim | 0.123 | 0.020 | 1.007 |
| Total number of observations | 2058 | 17807 | |
| Number of reflections | 81362 | 607 | 4670 |
| <I/σ(I)> | 3.9 | 12.5 | 0.6 |
| Completeness [%] | 92.9 | 92.5 | 98.3 |
| Redundancy | 3.7 | 3.4 | 3.8 |
| CC(1/2) | 0.994 | 0.999 | 0.520 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 8 | 291.15 | 13% PEG 8000, 0.1 M Tris, 20% Isopropanol |
