5U7W
Crystal structure of a nucleoside triphosphate diphosphohydrolase (NTPDase) from the legume Trifolium repens in complex with adenine and phosphate
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | AUSTRALIAN SYNCHROTRON BEAMLINE MX2 |
| Synchrotron site | Australian Synchrotron |
| Beamline | MX2 |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2009-05-01 |
| Detector | ADSC QUANTUM 315r |
| Wavelength(s) | 0.9537 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 53.910, 52.811, 72.180 |
| Unit cell angles | 90.00, 94.96, 90.00 |
Refinement procedure
| Resolution | 53.710 - 1.760 |
| R-factor | 0.18309 |
| Rwork | 0.181 |
| R-free | 0.22411 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 5u7p |
| RMSD bond length | 0.020 |
| RMSD bond angle | 2.046 |
| Data reduction software | MOSFLM |
| Data scaling software | SCALA |
| Phasing software | PHASER |
| Refinement software | REFMAC (5.7.0032) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 71.980 | |
| High resolution limit [Å] | 1.760 | |
| Rmerge | 0.136 | 0.725 |
| Number of reflections | 44133 | |
| <I/σ(I)> | 8.7 | 0.7 |
| Completeness [%] | 98.5 | 96 |
| Redundancy | 4.4 | 1.4 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 8 | 291 | 0.2 M ammonium dihydrogen orthophosphate, 15% PEG 3350 |
