4HV6
Structure of MNTR H77A mutant in apo- and mn-bound forms
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | ALS BEAMLINE 8.3.1 |
Synchrotron site | ALS |
Beamline | 8.3.1 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2007-08-15 |
Detector | ADSC QUANTUM 315r |
Spacegroup name | P 31 2 1 |
Unit cell lengths | 51.734, 51.734, 175.564 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 44.800 - 2.300 |
Rwork | 0.252 |
R-free | 0.31700 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 1on2 |
RMSD bond length | 0.011 |
RMSD bond angle | 1.080 |
Data reduction software | MOSFLM |
Data scaling software | SCALA |
Phasing software | EPMR |
Refinement software | PHENIX ((PHENIX.REFINE: 1.6.4_486)) |
Data quality characteristics
Overall | |
Low resolution limit [Å] | 44.800 |
High resolution limit [Å] | 2.300 |
Rmerge | 0.081 |
Number of reflections | 12767 |
<I/σ(I)> | 11.2 |
Completeness [%] | 99.4 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 8.5 | 293 | 16% ETHOXYETHANOL,4% ETHYLENE GLYCOL, 90 MM MGCL2, 60 MM TRIS HCL, 1 MM MNSO4, pH 8.5, VAPOR DIFFUSION, HANGING DROP, temperature 293K |