2YAY
The Crystal Structure of Leishmania major dUTPase in complex with substrate analogue dUpNpp
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | ESRF BEAMLINE ID14-2 |
| Synchrotron site | ESRF |
| Beamline | ID14-2 |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2010-03-03 |
| Detector | ADSC QUANTUM 4 |
| Spacegroup name | P 65 2 2 |
| Unit cell lengths | 86.830, 86.830, 145.280 |
| Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
| Resolution | 28.420 - 1.860 |
| R-factor | 0.21611 |
| Rwork | 0.214 |
| R-free | 0.24852 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 2cje |
| RMSD bond length | 0.013 |
| RMSD bond angle | 1.469 |
| Data reduction software | MOSFLM |
| Data scaling software | SCALA |
| Phasing software | REFMAC |
| Refinement software | REFMAC (5.5.0109) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 43.400 | 2.000 |
| High resolution limit [Å] | 1.900 | 1.900 |
| Rmerge | 0.050 | 0.910 |
| Number of reflections | 25978 | |
| <I/σ(I)> | 30.1 | 2.6 |
| Completeness [%] | 99.0 | 99 |
| Redundancy | 17.1 | 11.9 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | 0.2 M CACL2, 0.1 M MES PH 6.0, 20% PEG 6000. |
