3I9L
Crystal structure of ADP ribosyl cyclase complexed with N1-cIDPR
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | CHESS BEAMLINE A1 |
| Synchrotron site | CHESS |
| Beamline | A1 |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2007-03-31 |
| Detector | ADSC QUANTUM 210 |
| Wavelength(s) | 0.9771 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 69.627, 58.303, 71.651 |
| Unit cell angles | 90.00, 101.37, 90.00 |
Refinement procedure
| Resolution | 20.000 - 1.750 |
| R-factor | 0.16725 |
| Rwork | 0.166 |
| R-free | 0.19634 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 1lbe |
| RMSD bond length | 0.016 |
| RMSD bond angle | 1.971 |
| Data reduction software | HKL-2000 |
| Data scaling software | HKL-2000 |
| Phasing software | MOLREP |
| Refinement software | REFMAC (5.4.0067) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 30.000 | 1.810 |
| High resolution limit [Å] | 1.750 | 1.750 |
| Number of reflections | 56813 | |
| Completeness [%] | 99.8 | 97.7 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 7.5 | 298 | 0.1M imidazole, pH 7.5, 12-24% PEG 4000, VAPOR DIFFUSION, HANGING DROP, temperature 298K |
