2ZZ1
Snapshot of the reaction from 6-CN-UMP to BMP catalyzed by Orotidine Monophosphate Deacarboxylase from M. thermoautotrophicum
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | APS BEAMLINE 14-BM-C |
| Synchrotron site | APS |
| Beamline | 14-BM-C |
| Detector technology | CCD |
| Collection date | 2003-10-24 |
| Detector | ADSC QUANTUM 4 |
| Wavelength(s) | 0.9000 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 58.024, 73.543, 59.331 |
| Unit cell angles | 90.00, 119.29, 90.00 |
Refinement procedure
| Resolution | 51.990 - 1.570 |
| R-factor | 0.15685 |
| Rwork | 0.156 |
| R-free | 0.18249 |
| Structure solution method | FOURIER SYNTHESIS |
| Starting model (for MR) | 1x1z |
| RMSD bond length | 0.016 |
| RMSD bond angle | 1.677 |
| Data reduction software | HKL-2000 |
| Data scaling software | HKL-2000 |
| Phasing software | REFMAC |
| Refinement software | REFMAC (5.2.0019) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 100.000 | 1.600 |
| High resolution limit [Å] | 1.570 | 1.570 |
| Number of reflections | 60802 | |
| <I/σ(I)> | 22.1 | 5 |
| Completeness [%] | 99.7 | 99.8 |
| Redundancy | 3.8 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION | 1.2-1.36M Sodium Citrate, 5% dioxiane, pH 6.0-8.5, VAPOR DIFFUSION |
