6VPE
Crystal structure of transcriptional regulator from bacteriophage 186
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | AUSTRALIAN SYNCHROTRON BEAMLINE MX2 |
Synchrotron site | Australian Synchrotron |
Beamline | MX2 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2016-06-22 |
Detector | ADSC QUANTUM 315 |
Wavelength(s) | 1.4586 |
Spacegroup name | C 1 2 1 |
Unit cell lengths | 167.860, 46.140, 38.310 |
Unit cell angles | 90.00, 99.42, 90.00 |
Refinement procedure
Resolution | 44.447 - 2.211 |
R-factor | 0.233 |
Rwork | 0.227 |
R-free | 0.28290 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 6vli |
RMSD bond length | 0.004 |
RMSD bond angle | 0.653 |
Data reduction software | MOSFLM |
Data scaling software | Aimless |
Phasing software | MR-Rosetta |
Refinement software | PHENIX (1.10.1_2155) |
Data quality characteristics
Overall | Inner shell | Outer shell | |
Low resolution limit [Å] | 44.450 | 44.450 | 2.280 |
High resolution limit [Å] | 2.210 | 9.120 | 2.210 |
Rmerge | 0.144 | 0.096 | 0.854 |
Rmeas | 0.155 | 0.105 | 0.926 |
Rpim | 0.058 | 0.040 | 0.352 |
Total number of observations | 99947 | 1502 | 8094 |
Number of reflections | 14298 | 232 | 1197 |
<I/σ(I)> | 11.2 | 21 | 3.4 |
Completeness [%] | 97.8 | 99.3 | 95.5 |
Redundancy | 7 | 6.5 | 6.8 |
CC(1/2) | 0.995 | 0.992 | 0.775 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION | 289 | 2 M ammonium sulfate, 0.1 M Bis-Tris:HCl, pH 5.5 |