4HIB
Crystal structure of human orotidine 5'-monophosphate decarboxylase complexed with CMP-N4-OH
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | CLSI BEAMLINE 08ID-1 |
| Synchrotron site | CLSI |
| Beamline | 08ID-1 |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2011-01-26 |
| Detector | MARMOSAIC 300 mm CCD |
| Wavelength(s) | 0.979490 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 69.780, 61.640, 71.370 |
| Unit cell angles | 90.00, 112.08, 90.00 |
Refinement procedure
| Resolution | 66.080 - 1.800 |
| R-factor | 0.1952 |
| Rwork | 0.190 |
| R-free | 0.22300 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 2qcm |
| RMSD bond length | 0.028 |
| RMSD bond angle | 2.215 |
| Data scaling software | XSCALE |
| Phasing software | MOLREP |
| Refinement software | REFMAC |
Data quality characteristics
| Overall | Inner shell | Outer shell | |
| Low resolution limit [Å] | 50.000 | 100.000 | 1.580 |
| High resolution limit [Å] | 1.540 | 6.890 | 1.540 |
| Rmerge | 0.046 | 0.015 | 0.015 |
| Number of reflections | 70712 | 980 | 2002 |
| <I/σ(I)> | 13.96 | 47.91 | 0.44 |
| Completeness [%] | 85.0 | 98.4 | 32.7 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 7.5 | 293 | 1.6M-1.7M Ammonium sulphate, pH 7.5, VAPOR DIFFUSION, HANGING DROP, temperature 293K |
