5ZUQ
P domain of GII.17-1978
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SSRF BEAMLINE BL17U1 |
Synchrotron site | SSRF |
Beamline | BL17U1 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2016-03-14 |
Detector | ADSC QUANTUM 315r |
Wavelength(s) | 1.0 |
Spacegroup name | C 2 2 21 |
Unit cell lengths | 72.590, 101.635, 82.595 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 59.070 - 1.990 |
R-factor | 0.19381 |
Rwork | 0.191 |
R-free | 0.23940 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 3pun |
RMSD bond length | 0.007 |
RMSD bond angle | 1.260 |
Data reduction software | HKL-2000 |
Data scaling software | HKL-2000 |
Phasing software | PHASER |
Refinement software | REFMAC (5.8.0049) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 59.070 | 2.030 |
High resolution limit [Å] | 1.990 | 2.000 |
Rmerge | 0.128 | 0.512 |
Number of reflections | 20206 | 1027 |
<I/σ(I)> | 23.1 | 3.4 |
Completeness [%] | 94.7 | 96.9 |
Redundancy | 5.7 | 5.1 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 293 | 15% (w/v) polyethylene glycol (PEG) 3350, 0.2M MgCl2 |