4A0Z
Structure of the global transcription regulator FapR from Staphylococcus aureus in complex with malonyl-CoA
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | ESRF BEAMLINE ID14-4 |
Synchrotron site | ESRF |
Beamline | ID14-4 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2007-12-04 |
Detector | ADSC CCD |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 53.380, 68.500, 61.160 |
Unit cell angles | 90.00, 111.31, 90.00 |
Refinement procedure
Resolution | 49.730 - 1.900 |
R-factor | 0.19995 |
Rwork | 0.198 |
R-free | 0.23550 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 4a0x |
RMSD bond length | 0.012 |
RMSD bond angle | 1.393 |
Data reduction software | MOSFLM |
Data scaling software | SCALA |
Phasing software | AMoRE |
Refinement software | REFMAC (5.5.0044) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 44.000 | 2.000 |
High resolution limit [Å] | 1.900 | 1.900 |
Rmerge | 0.040 | 0.350 |
Number of reflections | 30557 | |
<I/σ(I)> | 16.4 | 3.6 |
Completeness [%] | 99.3 | 100 |
Redundancy | 3.7 | 3.7 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | 7.5 | 30% MPD, 5% PEG-4000, 0.1M NA HEPES, PH=7.5 |