2XLQ
Structural and Mechanistic Analysis of the Magnesium-Independent Aromatic Prenyltransferase CloQ from the Clorobiocin Biosynthetic Pathway
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | ROTATING ANODE |
Source details | RIGAKU RUH3R |
Temperature [K] | 100 |
Detector technology | IMAGE PLATE |
Collection date | 2006-09-09 |
Detector | MAR scanner 345 mm plate |
Spacegroup name | I 41 2 2 |
Unit cell lengths | 135.192, 135.192, 98.132 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 95.780 - 2.220 |
R-factor | 0.167 |
Rwork | 0.165 |
R-free | 0.21200 |
Structure solution method | SAD |
Starting model (for MR) | NONE |
RMSD bond length | 0.016 |
RMSD bond angle | 1.538 |
Data reduction software | MOSFLM |
Data scaling software | SCALA |
Phasing software | SHELX |
Refinement software | REFMAC (5.5.0091) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 31.860 | 2.330 |
High resolution limit [Å] | 2.210 | 2.210 |
Rmerge | 0.080 | 0.300 |
Number of reflections | 22556 | |
<I/σ(I)> | 8.63 | 2.57 |
Completeness [%] | 97.3 | 81.6 |
Redundancy | 7.75 | 7.36 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION | 6.5 | VAPOR DIFFUSION. PROTEIN (10 MG/ML) MIXED WITH AN EQUAL VOLUME OF 3 M SODIUM FORMATE, 2 MM DITHIOTHREITOL, 100 MM HEPES PH (6.5). |