3DNH
The crystal structure of the protein Atu2129 (unknown function) from Agrobacterium tumefaciens str. C58
Experimental procedure
| Experimental method | MAD |
| Source type | SYNCHROTRON |
| Source details | APS BEAMLINE 19-BM |
| Synchrotron site | APS |
| Beamline | 19-BM |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2008-01-30 |
| Detector | SBC-3 |
| Wavelength(s) | 0.97929, 0.97942 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 53.651, 66.830, 69.967 |
| Unit cell angles | 90.00, 108.19, 90.00 |
Refinement procedure
| Resolution | 29.760 - 1.940 |
| R-factor | 0.18928 |
| Rwork | 0.187 |
| R-free | 0.23804 |
| Structure solution method | MAD |
| RMSD bond length | 0.016 |
| RMSD bond angle | 1.647 |
| Data reduction software | HKL-3000 |
| Data scaling software | HKL-3000 |
| Phasing software | SHELXD |
| Refinement software | REFMAC (5.2.0019) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 30.000 | 2.010 |
| High resolution limit [Å] | 1.940 | 1.950 |
| Rmerge | 0.083 | 0.608 |
| Number of reflections | 34554 | |
| <I/σ(I)> | 22.8 | 1.67 |
| Completeness [%] | 99.7 | 98.7 |
| Redundancy | 4.3 | 3.8 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 6.5 | 293 | 0.1M Bis-tris, 0.2M Na(OAc), 30% PEG 8K, pH 6.5, VAPOR DIFFUSION, HANGING DROP, temperature 293K |
