6F18
Structure of Mb NMH H64V, V68A mutant complex with EDA
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SLS BEAMLINE X06SA |
Synchrotron site | SLS |
Beamline | X06SA |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2017-09-02 |
Detector | DECTRIS EIGER X 16M |
Wavelength(s) | 1.00000 |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 39.635, 47.612, 76.600 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 40.437 - 1.800 |
R-factor | 0.1765 |
Rwork | 0.172 |
R-free | 0.21220 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 1a6k |
RMSD bond length | 0.009 |
RMSD bond angle | 0.853 |
Data reduction software | XDS |
Data scaling software | XDS |
Phasing software | PHASER |
Refinement software | PHENIX ((1.11.1_2575: ???)) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 47.600 | 1.840 |
High resolution limit [Å] | 1.800 | 1.800 |
Rmerge | 0.049 | 0.577 |
Number of reflections | 13995 | |
<I/σ(I)> | 20.1 | 2.8 |
Completeness [%] | 99.8 | 99.9 |
Redundancy | 6.2 | 6.2 |
CC(1/2) | 0.999 | 0.877 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 293 | 0.1 M SPG buffer at pH 6.8-7.2 containing 28-32%(w/v) PEG1500. |