1W2Y
The crystal structure of a complex of Campylobacter jejuni dUTPase with substrate analogue dUpNHp
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | ESRF BEAMLINE BM14 |
| Synchrotron site | ESRF |
| Beamline | BM14 |
| Temperature [K] | 100 |
| Collection date | 2003-07-14 |
| Spacegroup name | P 21 21 21 |
| Unit cell lengths | 66.963, 70.629, 92.850 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 55.900 - 1.650 |
| R-factor | 0.153 |
| Rwork | 0.151 |
| R-free | 0.19400 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 1ogk |
| RMSD bond length | 0.017 |
| RMSD bond angle | 1.581 |
| Data scaling software | SCALEPACK |
| Phasing software | MOLREP |
| Refinement software | REFMAC (5.2.0003) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 50.000 | 1.710 |
| High resolution limit [Å] | 1.650 | 1.650 |
| Rmerge | 0.060 | 0.450 |
| Number of reflections | 53061 | |
| <I/σ(I)> | 34 | 2.7 |
| Completeness [%] | 99.4 | 98.5 |
| Redundancy | 5.2 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | 7 | 25-30% MPD, 5% ISOPROPANOL, 50 MM MG-ACETATE, 100 MM HEPES PH 7.0 |
