4HV8
Crystal Structure of H2Db-H155A-NPM6I
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 | 2011-07-29 |
Detector | ADSC QUANTUM 210 |
Wavelength(s) | 0.956 |
Spacegroup name | P 1 2 1 |
Unit cell lengths | 83.920, 72.930, 86.380 |
Unit cell angles | 90.00, 103.11, 90.00 |
Refinement procedure
Resolution | 72.930 - 2.000 |
R-factor | 0.1835 |
Rwork | 0.181 |
R-free | 0.23580 |
Starting model (for MR) | 3cpl |
RMSD bond length | 0.010 |
RMSD bond angle | 1.090 |
Data scaling software | XSCALE |
Phasing software | PHASER |
Refinement software | BUSTER-TNT |
Data quality characteristics
Overall | Inner shell | Outer shell | |
Low resolution limit [Å] | 100.000 | 2.100 | |
High resolution limit [Å] | 2.000 | 10.000 | 2.000 |
Rmerge | 0.067 | 0.019 | 0.483 |
Number of reflections | 68339 | ||
<I/σ(I)> | 13.5 | 37.51 | 2.84 |
Completeness [%] | 99.3 | 95.4 | 99.9 |
Redundancy | 3.7 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 8.5 | 298 | 0.1M Tris HCl, 0.2M LiSO4, 25-30% PEG 8000, pH 8.5, vapor diffusion, hanging drop, temperature 298K |