5W6C
UCA Fab (unbound) from 6649 Lineage
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | APS BEAMLINE 24-ID-E |
Synchrotron site | APS |
Beamline | 24-ID-E |
Temperature [K] | 293.15 |
Detector technology | CCD |
Collection date | 2016-10-14 |
Detector | ADSC QUANTUM 315 |
Wavelength(s) | 0.999919 |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 63.640, 66.920, 100.150 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 46.116 - 1.634 |
R-factor | 0.1781 |
Rwork | 0.177 |
R-free | 0.20140 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 3h42 |
RMSD bond length | 0.006 |
RMSD bond angle | 0.947 |
Data reduction software | XDS |
Data scaling software | XSCALE |
Phasing software | PHASER |
Refinement software | PHENIX (1.10_2155) |
Data quality characteristics
Overall | Inner shell | Outer shell | |
Low resolution limit [Å] | 46.116 | 46.116 | 1.730 |
High resolution limit [Å] | 1.630 | 4.880 | 1.630 |
Rmerge | 0.048 | 0.021 | 0.509 |
Rmeas | 0.052 | 0.023 | 0.595 |
Total number of observations | 347776 | ||
Number of reflections | 52465 | 2187 | 7093 |
<I/σ(I)> | 27.48 | 65.46 | 3.03 |
Completeness [%] | 97.0 | 99.8 | 81.5 |
Redundancy | 6.629 | 6.775 | 3.263 |
CC(1/2) | 0.999 | 1.000 | 0.848 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 4.6 | 293.15 | 26% PEG2000 MME, 150 mM ammonium sulfate, 100 mM sodium acetate, pH 4.6 |