3CJ9
Structure of Rattus norvegicus NTPDase2 in complex with calcium, AMP and phosphate
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | BESSY BEAMLINE 14.1 |
| Synchrotron site | BESSY |
| Beamline | 14.1 |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2007-05-09 |
| Detector | MARMOSAIC 225 mm CCD |
| Wavelength(s) | 0.9184 |
| Spacegroup name | P 21 21 21 |
| Unit cell lengths | 41.059, 69.206, 164.364 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 25.470 - 1.800 |
| R-factor | 0.16348 |
| Rwork | 0.162 |
| R-free | 0.20557 |
| Structure solution method | SIRAS |
| RMSD bond length | 0.019 |
| RMSD bond angle | 1.619 |
| Data reduction software | MOSFLM |
| Data scaling software | SCALA |
| Phasing software | SHARP |
| Refinement software | REFMAC (5.2.0019) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 25.470 | 1.900 |
| High resolution limit [Å] | 1.800 | 1.800 |
| Rmerge | 0.095 | 0.457 |
| Number of reflections | 44443 | |
| <I/σ(I)> | 15.8 | 2.7 |
| Completeness [%] | 99.9 | 99.7 |
| Redundancy | 7 | 4.9 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 7.2 | 277 | 100mM NaHEPES, 2% PEG 6000, pH 7.2, VAPOR DIFFUSION, HANGING DROP, temperature 277K |
