7BPD
Crystal structural analysis of Swine dUTPase
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SSRF BEAMLINE BL19U1 |
Synchrotron site | SSRF |
Beamline | BL19U1 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2019-10-14 |
Detector | ADSC QUANTUM 315 |
Wavelength(s) | 0.97835 |
Spacegroup name | C 1 2 1 |
Unit cell lengths | 116.175, 54.535, 52.107 |
Unit cell angles | 90.00, 116.68, 90.00 |
Refinement procedure
Resolution | 46.620 - 2.040 |
R-factor | 0.21 |
Rwork | 0.207 |
R-free | 0.25750 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 2hqu |
RMSD bond length | 0.008 |
RMSD bond angle | 1.587 |
Data reduction software | HKL-2000 |
Data scaling software | HKL-2000 |
Phasing software | PHASER |
Refinement software | REFMAC (5.8.0238) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 51.900 | 2.080 |
High resolution limit [Å] | 2.030 | 2.040 |
Rmerge | 0.058 | 0.297 |
Rmeas | 0.074 | 0.968 |
Rpim | 0.029 | 0.378 |
Number of reflections | 35796 | 1301 |
<I/σ(I)> | 23.67 | 2 |
Completeness [%] | 83.0 | |
Redundancy | 5.7 | |
CC(1/2) | 0.992 | 0.972 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 7.4 | 293 | 200mM NaI, 20% (w/v) PEG 3350 |