4CCL
X-Ray structure of E. coli ycfD
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | DIAMOND BEAMLINE I03 |
Synchrotron site | Diamond |
Beamline | I03 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2009-04-04 |
Detector | ADSC CCD |
Spacegroup name | P 43 21 2 |
Unit cell lengths | 120.693, 120.693, 133.498 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 41.765 - 2.596 |
R-factor | 0.2016 |
Rwork | 0.198 |
R-free | 0.24900 |
Structure solution method | SAD |
Starting model (for MR) | NONE |
RMSD bond length | 0.004 |
RMSD bond angle | 1.070 |
Data reduction software | DENZO |
Data scaling software | SCALEPACK |
Phasing software | SOLVE |
Refinement software | PHENIX ((PHENIX.REFINE)) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 44.800 | 2.690 |
High resolution limit [Å] | 2.600 | 2.600 |
Rmerge | 0.090 | |
Number of reflections | 31066 | |
<I/σ(I)> | 17.3 | 1.2 |
Completeness [%] | 99.9 | 99.4 |
Redundancy | 7.2 | 6 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | 8.5 | 0.1M TRIS.HCL PH 8.5, 0.2M LITHIUM SULPHATE, 1.26 M AMMONIUM SULFATE, 0.001 M FECL2 |