1DUT
FIV DUTP PYROPHOSPHATASE
Experimental procedure
| Source type | SYNCHROTRON |
| Source details | SSRL BEAMLINE BL7-1 |
| Synchrotron site | SSRL |
| Beamline | BL7-1 |
| Detector technology | IMAGE PLATE |
| Detector | MARRESEARCH |
| Spacegroup name | P 63 |
| Unit cell lengths | 79.800, 79.800, 86.950 |
| Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
| Resolution | 7.000 - 1.900 |
| R-factor | 0.209 |
| Rwork | 0.209 |
| R-free | 0.24900 |
| RMSD bond length | 0.015 |
| RMSD bond angle | 2.400 |
| Data reduction software | MOSFLM |
| Phasing software | X-PLOR (3.1) |
| Refinement software | X-PLOR (3.1) |
Data quality characteristics
| Overall | |
| High resolution limit [Å] | 1.900 * |
| Rmerge | 0.064 |
| Total number of observations | 116665 * |
| Number of reflections | 23522 * |
| Completeness [%] | 96.3 |
| Redundancy | 4.96 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | Vapor diffusion, sitting drop * | 7.5 * | 22.5 * | used to seeding * |
Crystallization Reagents in Literatures
| ID | crystal ID | solution | reagent name | concentration (unit) | details |
| 1 | 1 | drop | Tris-HCl | 29 (mM) | |
| 2 | 1 | drop | 2.9 (mM) | ||
| 3 | 1 | drop | 2-mercaptoethanol | 1.2 (mM) | |
| 4 | 1 | drop | enzyme | 1.2 (mg/ml) | |
| 5 | 1 | drop | MPEG5000 | 5.4 (%) | |
| 6 | 1 | drop | sodium cacodylate | 42 (mM) | |
| 7 | 1 | reservoir | MPEG5000 | 13 (%) | |
| 8 | 1 | reservoir | sodium cacodylate | 100 (mM) |
