4ACK
3D Structure of DotU from Francisella novicida
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SSRL BEAMLINE BL9-2 |
Synchrotron site | SSRL |
Beamline | BL9-2 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2010-04-01 |
Detector | MARMOSAIC 325 mm CCD |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 39.660, 85.840, 67.710 |
Unit cell angles | 90.00, 102.93, 90.00 |
Refinement procedure
Resolution | 65.990 - 2.150 |
R-factor | 0.19691 |
Rwork | 0.194 |
R-free | 0.25118 |
Structure solution method | MIRAS |
Starting model (for MR) | NONE |
RMSD bond length | 0.023 |
RMSD bond angle | 1.778 |
Data reduction software | MOSFLM |
Data scaling software | SCALEPACK |
Phasing software | autoSHARP |
Refinement software | REFMAC (5.0) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 65.990 | 2.270 |
High resolution limit [Å] | 2.150 | 2.150 |
Rmerge | 0.080 | 0.410 |
Number of reflections | 24116 | |
<I/σ(I)> | 14.9 | 5 |
Completeness [%] | 99.9 | 99.9 |
Redundancy | 7.6 | 7.6 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | 8 | 0.115 M KBR, 0.1 M TRIS, PH 8.5, 20% PEG 3350 |