5MLX
Open loop conformation of PhaZ7 Y105E mutant
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | EMBL/DESY, HAMBURG BEAMLINE X13 |
Synchrotron site | EMBL/DESY, HAMBURG |
Beamline | X13 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2010-04-09 |
Detector | MARRESEARCH |
Wavelength(s) | 0.8123 |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 41.300, 199.500, 44.400 |
Unit cell angles | 90.00, 114.20, 90.00 |
Refinement procedure
Resolution | 23.082 - 1.600 |
R-factor | 0.1273 |
Rwork | 0.126 |
R-free | 0.15200 |
Structure solution method | FOURIER SYNTHESIS |
Starting model (for MR) | 4brs |
RMSD bond length | 0.008 |
RMSD bond angle | 0.882 |
Data reduction software | XDS |
Data scaling software | XDS |
Phasing software | PHENIX |
Refinement software | PHENIX ((1.11.1_2575: ???)) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 23.100 | 1.690 |
High resolution limit [Å] | 1.600 | 1.600 |
Rmerge | 0.130 | |
Number of reflections | 77568 | |
<I/σ(I)> | 18.6 | 7.1 |
Completeness [%] | 89.9 | 91.2 |
Redundancy | 2.8 | 2.2 |
CC(1/2) | 0.998 | 0.959 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 5 | 289 | 0.2 M NH4Cl, O.1 M sodium acetate, 20% PEG6000 |