4GB7
Putative 6-aminohexanoate-dimer hydrolase from Bacillus anthracis
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | APS BEAMLINE 19-BM |
| Synchrotron site | APS |
| Beamline | 19-BM |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2012-07-13 |
| Detector | ADSC QUANTUM 210r |
| Wavelength(s) | 0.9792 |
| Spacegroup name | P 21 21 21 |
| Unit cell lengths | 60.696, 61.595, 111.841 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 32.000 - 1.600 |
| R-factor | 0.1347 |
| Rwork | 0.132 |
| R-free | 0.19700 |
| Structure solution method | SAD |
| RMSD bond length | 0.015 |
| RMSD bond angle | 1.582 |
| Data reduction software | DENZO |
| Data scaling software | SCALEPACK |
| Phasing software | MOLREP |
| Refinement software | REFMAC (5.6.0117) |
Data quality characteristics
| Overall | Inner shell | Outer shell | |
| Low resolution limit [Å] | 31.800 | 50.000 | 1.630 |
| High resolution limit [Å] | 1.600 | 4.340 | 1.600 |
| Rmerge | 0.114 | 0.100 | 0.468 |
| Number of reflections | 54699 | ||
| <I/σ(I)> | 14.6 | 2.09 | |
| Completeness [%] | 97.5 | 89.5 | 88.4 |
| Redundancy | 5.5 | 5.5 | 2.6 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 6.3 | 289 | 0.2 M ammonium nitrate, 20% PEG-3350, pH 6.3, VAPOR DIFFUSION, SITTING DROP, temperature 289K |
