3ZX0
NTPDase1 in complex with Heptamolybdate
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | BESSY BEAMLINE 14.3 |
| Synchrotron site | BESSY |
| Beamline | 14.3 |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2010-08-19 |
| Detector | MARRESEARCH |
| Spacegroup name | C 1 2 1 |
| Unit cell lengths | 163.807, 80.267, 164.921 |
| Unit cell angles | 90.00, 117.92, 90.00 |
Refinement procedure
| Resolution | 145.730 - 2.500 |
| R-factor | 0.21426 |
| Rwork | 0.213 |
| R-free | 0.25718 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 3cj1 |
| RMSD bond length | 0.015 |
| RMSD bond angle | 2.544 |
| Data reduction software | XDS |
| Data scaling software | SCALA |
| Phasing software | MOLREP |
| Refinement software | REFMAC (5.6.0117) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 29.150 | 2.630 |
| High resolution limit [Å] | 2.500 | 2.500 |
| Rmerge | 0.060 | 0.200 |
| Number of reflections | 57453 | |
| <I/σ(I)> | 9.7 | 2 |
| Completeness [%] | 87.6 | 28.6 |
| Redundancy | 3 | 2 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | 4.2 | 3.8M NACL, 100MM NAACETAT PH 4.2 |
