3ZC7
VbhT Fic protein from Bartonella schoenbuchensis in complex with VbhA antitoxin and ATP
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SLS BEAMLINE X06DA |
| Synchrotron site | SLS |
| Beamline | X06DA |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2011-02-21 |
| Detector | MARMOSAIC 225 mm CCD |
| Spacegroup name | C 1 2 1 |
| Unit cell lengths | 106.460, 40.620, 73.740 |
| Unit cell angles | 90.00, 121.55, 90.00 |
Refinement procedure
| Resolution | 15.000 - 2.100 |
| R-factor | 0.1679 |
| Rwork | 0.165 |
| R-free | 0.23190 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 3shg |
| RMSD bond length | 0.007 |
| RMSD bond angle | 1.008 |
| Data reduction software | XDS |
| Data scaling software | XDS |
| Phasing software | PHASER |
| Refinement software | PHENIX ((PHENIX.REFINE)) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 45.360 | 2.200 |
| High resolution limit [Å] | 2.100 | 2.100 |
| Rmerge | 0.080 | 0.340 |
| Number of reflections | 15824 | |
| <I/σ(I)> | 18.87 | 5.86 |
| Completeness [%] | 98.8 | 93.6 |
| Redundancy | 5.4 | 4.89 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | 6.5 | 15% PEG 4000, 0.1M MES PH 6.5. THEN SOAKED WITH 5MM ATP AND 5MM MGCL2U. |
