6A1K
Phosphate acyltransferase PlsX from B.subtilis
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SSRF BEAMLINE BL17B1 |
Synchrotron site | SSRF |
Beamline | BL17B1 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2016-09-11 |
Detector | ADSC QUANTUM 315r |
Wavelength(s) | 0.979 |
Spacegroup name | C 2 2 2 |
Unit cell lengths | 108.520, 144.760, 84.840 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 33.288 - 2.300 |
R-factor | 0.2043 |
Rwork | 0.202 |
R-free | 0.23760 |
RMSD bond length | 0.007 |
RMSD bond angle | 0.976 |
Data reduction software | MOSFLM |
Data scaling software | Aimless |
Phasing software | PHENIX |
Refinement software | PHENIX (1.11.1_2575) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 33.290 | 2.382 |
High resolution limit [Å] | 2.300 | 2.300 |
Rmerge | 0.100 | 0.428 |
Rmeas | 0.118 | 0.510 |
Rpim | 0.062 | 0.273 |
Number of reflections | 29907 | 2564 |
<I/σ(I)> | 11.5 | 3.1 |
Completeness [%] | 96.2 | 90.9 |
Redundancy | 6.4 | 5.6 |
CC(1/2) | 0.993 | 0.929 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 8 | 293 | 0.08 M Tris 8.0, 0.16 M Li2SO4, 21% PEG 4000, 0.012 mM CYMAL 7, 5 % t-butanol |