5U0W
E. coli dihydropteroate synthase complexed with 9-methylguanine
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | AUSTRALIAN SYNCHROTRON BEAMLINE MX1 |
| Synchrotron site | Australian Synchrotron |
| Beamline | MX1 |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2010-10-20 |
| Detector | ADSC QUANTUM 210 |
| Wavelength(s) | 0.95370 |
| Spacegroup name | C 1 2 1 |
| Unit cell lengths | 95.542, 85.513, 84.281 |
| Unit cell angles | 90.00, 111.52, 90.00 |
Refinement procedure
| Resolution | 19.771 - 1.968 |
| R-factor | 0.1892 |
| Rwork | 0.188 |
| R-free | 0.22250 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 1aj2 |
| RMSD bond length | 0.009 |
| RMSD bond angle | 1.173 |
| Data reduction software | XDS |
| Data scaling software | Aimless |
| Phasing software | PHASER |
| Refinement software | PHENIX ((1.10.1_2155: ???)) |
Data quality characteristics
| Overall | |
| Low resolution limit [Å] | 19.771 |
| High resolution limit [Å] | 1.968 |
| Rmerge | 0.084 |
| Number of reflections | 44542 |
| <I/σ(I)> | 13.8 |
| Completeness [%] | 99.5 |
| Redundancy | 7.4 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 6 | 281 | 16.9% PEG8000 0.1 M sodium cacodylate, pH 6.0 0.143M MgNO3 Protein at 15 mg.mL-1 |
