3TLB
Microcin C7 self immunity protein MccF in complex aspartyl sulfamoyl adenosine
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | APS BEAMLINE 21-ID-D |
Synchrotron site | APS |
Beamline | 21-ID-D |
Detector technology | CCD |
Collection date | 2010-02-22 |
Detector | MARMOSAIC 300 mm CCD |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 54.431, 85.675, 72.892 |
Unit cell angles | 90.00, 101.31, 90.00 |
Refinement procedure
Resolution | 25.000 - 1.501 |
R-factor | 0.1807 |
Rwork | 0.180 |
R-free | 0.20200 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 3tla |
RMSD bond length | 0.006 |
RMSD bond angle | 0.986 |
Data reduction software | DENZO |
Data scaling software | SCALEPACK |
Refinement software | REFMAC (5.5.0056) |
Data quality characteristics
Overall | Inner shell | Outer shell | |
Low resolution limit [Å] | 50.000 | 50.000 | 1.550 |
High resolution limit [Å] | 1.500 | 3.230 | 1.500 |
Rmerge | 0.058 | 0.046 | 0.244 |
Number of reflections | 99681 | ||
<I/σ(I)> | 11.2 | ||
Completeness [%] | 95.6 | 99.4 | 85 |
Redundancy | 6 | 6.4 | 5.3 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 7.5 | 282 | 10% PEG 8000, 8% ethylene glycol, 0.1 M HEPES, pH 7.5, vapor diffusion, hanging drop, temperature 282K |