3G11
Structure of E. coli FabF(C163Q) in complex with dihydrophenyl platensimycin
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | APS BEAMLINE 17-ID |
Synchrotron site | APS |
Beamline | 17-ID |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2004-12-10 |
Detector | ADSC QUANTUM 210 |
Wavelength(s) | 1.0 |
Spacegroup name | P 31 2 1 |
Unit cell lengths | 76.283, 76.283, 146.579 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 65.940 - 2.000 |
R-factor | 0.168 |
Rwork | 0.166 |
R-free | 0.20380 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 2gfx |
RMSD bond length | 0.011 |
RMSD bond angle | 1.386 |
Data reduction software | DENZO |
Data scaling software | SCALEPACK |
Phasing software | MOLREP |
Refinement software | TNT |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 66.000 | 2.070 |
High resolution limit [Å] | 2.000 | 2.000 |
Rmerge | 0.057 | 0.471 |
Number of reflections | 34015 | |
<I/σ(I)> | 36.572 | |
Completeness [%] | 99.9 | 100 |
Redundancy | 7.3 | 7.3 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 8 | 293 | 19-24% PEG 8000, 0.1M Tris, 10mM BME, pH 8.0, VAPOR DIFFUSION, HANGING DROP, temperature 293K |