5NNL
Inactive dihydroorotase-like domain of Chaetomium thermophilum CAD-like multifunctional protein
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | ESRF BEAMLINE ID30B |
Synchrotron site | ESRF |
Beamline | ID30B |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2015-06-26 |
Detector | DECTRIS PILATUS3 S 6M |
Wavelength(s) | 0.93927 |
Spacegroup name | P 21 21 2 |
Unit cell lengths | 100.771, 109.177, 58.314 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 45.814 - 2.130 |
R-factor | 0.2004 |
Rwork | 0.199 |
R-free | 0.23200 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 4c6m |
RMSD bond length | 0.003 |
RMSD bond angle | 0.606 |
Data reduction software | XDS |
Data scaling software | SCALA |
Phasing software | PHASER |
Refinement software | PHENIX ((1.11.1_2575: ???)) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 48.000 | 2.250 |
High resolution limit [Å] | 2.130 | 2.130 |
Rmerge | 0.110 | 0.984 |
Rpim | 0.047 | 0.411 |
Number of reflections | 36234 | 5197 |
<I/σ(I)> | 11.3 | 2 |
Completeness [%] | 98.8 | 97.9 |
Redundancy | 6.5 | 6.6 |
CC(1/2) | 0.998 | 0.702 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 4.5 | 291 | A construct spanning the DHO-like and ATC domains of C. thermophilum CAD-like protein was used for crystallization at 5 mg/ml. Crystals appear after 2-3 weeks in conditions with 20% PEG 20,000 and 0.1 M citric acid pH 4.5. The crystals only contained the DHO-like domain of the construct that was cleaved off during crystallization. |