9AZG
Native nnhA in H32
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | AUSTRALIAN SYNCHROTRON BEAMLINE MX2 |
| Synchrotron site | Australian Synchrotron |
| Beamline | MX2 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2015-07-16 |
| Detector | DECTRIS EIGER X 16M |
| Wavelength(s) | 1.45861 |
| Spacegroup name | H 3 2 |
| Unit cell lengths | 206.360, 206.360, 70.303 |
| Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
| Resolution | 48.710 - 2.162 |
| Rwork | 0.168 |
| R-free | 0.20650 |
| Structure solution method | SAD |
| RMSD bond length | 0.007 |
| RMSD bond angle | 1.553 |
| Data reduction software | XDS |
| Data scaling software | Aimless |
| Phasing software | Auto-Rickshaw |
| Refinement software | REFMAC (5.8.0425) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 48.710 | 2.230 |
| High resolution limit [Å] | 2.160 | 2.160 |
| Rmerge | 0.157 | 0.733 |
| Rpim | 0.020 | 0.165 |
| Number of reflections | 30547 | 2620 |
| <I/σ(I)> | 28.1 | 4.9 |
| Completeness [%] | 99.9 | 98.7 |
| Redundancy | 59.1 | 20.2 |
| CC(1/2) | 0.999 | 0.973 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 7.2 | 293 | Protein at 7mg/mL was set up in sitting drops with 300 nL of protein and 150 nL reservoir. The reservoir solution consisted of 21% polyacrylic acid 5100, 20 mM MgCl2 and 100 mM HEPES pH 7.2 at 20 C |
