6F1A
Structure of Mb NMH H64V, V68A mutant complex with EDA incubated at room temperature for 20 min
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) | 1.0000 |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 39.817, 47.734, 77.673 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 40.668 - 2.399 |
R-factor | 0.2206 |
Rwork | 0.214 |
R-free | 0.27280 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 1a6k |
RMSD bond length | 0.015 |
RMSD bond angle | 1.347 |
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] | 47.700 | 2.490 |
High resolution limit [Å] | 2.399 | 2.399 |
Rmerge | 0.392 | 1.355 |
Number of reflections | 6198 | |
<I/σ(I)> | 6.3 | 3 |
Completeness [%] | 100.0 | 99.9 |
Redundancy | 6.2 | 6.7 |
CC(1/2) | 0.958 | 0.600 |
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. |