3QJG
Epidermin biosynthesis protein EpiD from Staphylococcus aureus
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | APS BEAMLINE 19-BM |
Synchrotron site | APS |
Beamline | 19-BM |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2010-08-12 |
Detector | ADSC QUANTUM 210r |
Wavelength(s) | 0.9792 |
Spacegroup name | C 1 2 1 |
Unit cell lengths | 160.991, 111.256, 154.569 |
Unit cell angles | 90.00, 97.25, 90.00 |
Refinement procedure
Resolution | 45.800 - 2.040 |
R-factor | 0.211 |
Rwork | 0.208 |
R-free | 0.26260 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 1g5q |
RMSD bond length | 0.017 |
RMSD bond angle | 1.629 |
Data reduction software | DENZO |
Data scaling software | SCALEPACK |
Phasing software | MOLREP |
Refinement software | REFMAC (5.5.0109) |
Data quality characteristics
Overall | Inner shell | Outer shell | |
Low resolution limit [Å] | 45.800 | 50.000 | 2.090 |
High resolution limit [Å] | 2.040 | 5.560 | 2.040 |
Rmerge | 0.116 | 0.067 | 0.481 |
Number of reflections | 162302 | ||
<I/σ(I)> | 8.1 | 2.08 | |
Completeness [%] | 95.3 | 99.7 | 74.4 |
Redundancy | 3.9 | 4.2 | 2.5 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 6.5 | 289 | 0.1 M Bis-Tris, 20% PEG-MME-5000, pH 6.5, VAPOR DIFFUSION, HANGING DROP, temperature 289K |