7UOF
Dihydroorotase from M. jannaschii
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | ALS BEAMLINE 4.2.2 |
Synchrotron site | ALS |
Beamline | 4.2.2 |
Temperature [K] | 298 |
Detector technology | CMOS |
Collection date | 2018-12-18 |
Detector | RDI CMOS_8M |
Wavelength(s) | 1.0 |
Spacegroup name | P 32 2 1 |
Unit cell lengths | 111.267, 111.267, 101.233 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 48.180 - 1.900 |
R-factor | 0.1799 |
Rwork | 0.178 |
R-free | 0.21460 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 3mpg |
RMSD bond length | 0.008 |
RMSD bond angle | 0.935 |
Data reduction software | XDS |
Data scaling software | Aimless |
Phasing software | PHASER |
Refinement software | PHENIX (1.19.2_4158) |
Data quality characteristics
Overall | Inner shell | Outer shell | |
Low resolution limit [Å] | 48.180 | 48.180 | 1.940 |
High resolution limit [Å] | 1.900 | 9.110 | 1.900 |
Rmerge | 0.239 | 0.054 | 3.188 |
Number of reflections | 57394 | 593 | 3683 |
<I/σ(I)> | 9.7 | ||
Completeness [%] | 100.0 | 99.2 | 100 |
Redundancy | 10.9 | 9 | 10 |
CC(1/2) | 0.997 | 0.996 | 0.310 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 7.5 | 298 | 35% PEG400, 0.1 M Na Hepes pH 7.5, 0.1 M Zn acetate. |