3MGX
Crystal Structure of P450 OxyD that is involved in the Biosynthesis of Vancomycin-type Antibiotics
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SLS BEAMLINE X10SA |
Synchrotron site | SLS |
Beamline | X10SA |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2009-08-10 |
Detector | MARMOSAIC 225 mm CCD |
Wavelength(s) | 0.99986 |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 65.850, 61.050, 100.640 |
Unit cell angles | 90.00, 102.48, 90.00 |
Refinement procedure
Resolution | 19.750 - 2.100 |
R-factor | 0.20913 |
Rwork | 0.208 |
R-free | 0.23302 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 3ejb |
RMSD bond length | 0.006 |
RMSD bond angle | 0.884 |
Data reduction software | XDS |
Data scaling software | XDS |
Phasing software | PHASER |
Refinement software | REFMAC (5.5.0070) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 20.000 | 2.200 |
High resolution limit [Å] | 2.100 | 2.100 |
Rmerge | 0.060 | 0.300 |
Number of reflections | 44661 | |
<I/σ(I)> | 19.2 | 4.5 |
Completeness [%] | 97.5 | 92.4 |
Redundancy | 7.9 | 8 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 6.8 | 293 | 18% PEG 2000 MME, 0.1M Bis-Tris, pH 6.8, VAPOR DIFFUSION, HANGING DROP, temperature 293K |