3K6L
The structure of E.coli peptide deformylase (PDF) in complex with peptidomimetic ligand BB2827
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | DIAMOND BEAMLINE I02 |
| Synchrotron site | Diamond |
| Beamline | I02 |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2009-08-12 |
| Detector | ADSC QUANTUM 315 |
| Wavelength(s) | 0.9795 |
| Spacegroup name | P 43 2 2 |
| Unit cell lengths | 73.960, 73.960, 241.500 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 241.500 - 2.150 |
| R-factor | 0.26113 |
| Rwork | 0.258 |
| R-free | 0.31919 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 1g27 |
| RMSD bond length | 0.009 |
| RMSD bond angle | 1.162 |
| Data reduction software | MOSFLM |
| Data scaling software | SCALA |
| Phasing software | PHASER |
| Refinement software | REFMAC (5.5.0102) |
Data quality characteristics
| Overall | |
| Low resolution limit [Å] | 241.500 |
| High resolution limit [Å] | 2.150 |
| Rmerge | 0.069 |
| Number of reflections | 37679 |
| <I/σ(I)> | 8.4 |
| Completeness [%] | 90.8 |
| Redundancy | 7.5 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 294 | 20% PEG3350, 0.2M Potassium formate, VAPOR DIFFUSION, SITTING DROP, temperature 294K |
