2PZK
Crystal structure of the Bordetella bronchiseptica enzyme WbmG in complex with NAD
Experimental procedure
| Experimental method | MAD |
| Source type | SYNCHROTRON |
| Source details | SRS BEAMLINE PX14.1 |
| Synchrotron site | SRS |
| Beamline | PX14.1 |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2004-12-13 |
| Detector | ADSC QUANTUM 4 |
| Wavelength(s) | 1.488, 0.97905 , 0.97938, 0.97668 |
| Spacegroup name | C 1 2 1 |
| Unit cell lengths | 192.041, 49.760, 76.023 |
| Unit cell angles | 90.00, 101.13, 90.00 |
Refinement procedure
| Resolution | 26.830 - 2.100 |
| R-factor | 0.1883 |
| Rwork | 0.185 |
| R-free | 0.24207 |
| Structure solution method | MAD |
| RMSD bond length | 0.014 |
| RMSD bond angle | 1.598 |
| Data reduction software | DENZO |
| Data scaling software | SCALEPACK |
| Phasing software | PHENIX |
| Refinement software | REFMAC (5.2.0019) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 30.000 | 2.150 |
| High resolution limit [Å] | 2.100 | 2.100 |
| Rmerge | 0.075 | 0.483 |
| Number of reflections | 38661 | |
| <I/σ(I)> | 16.9 | 2.14 |
| Completeness [%] | 97.6 | 79.2 |
| Redundancy | 3.83 | 3.08 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 8.5 | 293 | 0.1 M Tris, 0.2 M MgCl2, 16-18 % (w/w) PEG 8000, pH 8.5, VAPOR DIFFUSION, HANGING DROP, temperature 293K |
