9FRT
Crystal structure of trans-o-hydroxybenzylidenepyruvate hydratase-aldolase from Pseudomonas fluorescens N3
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | ESRF BEAMLINE ID14-1 |
| Synchrotron site | ESRF |
| Beamline | ID14-1 |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2010-09-12 |
| Detector | ADSC QUANTUM 4 |
| Wavelength(s) | 0.9334 |
| Spacegroup name | C 1 2 1 |
| Unit cell lengths | 199.700, 199.890, 144.150 |
| Unit cell angles | 90.00, 133.79, 90.00 |
Refinement procedure
| Resolution | 36.040 - 1.960 |
| Rwork | 0.139 |
| R-free | 0.16840 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.011 |
| RMSD bond angle | 1.815 |
| Data reduction software | iMOSFLM |
| Data scaling software | SCALA |
| Phasing software | MOLREP |
| Refinement software | REFMAC (5.8.0425) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 36.040 | 2.060 |
| High resolution limit [Å] | 1.960 | 1.960 |
| Rmeas | 0.134 | 0.218 |
| Number of reflections | 277447 | 40163 |
| <I/σ(I)> | 5.1 | 3.4 |
| Completeness [%] | 95.6 | |
| Redundancy | 2 | |
| CC(1/2) | 0.933 | 0.897 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 293 | 0.4 M Ammonium phosphate monobasic |
