2X9J
Structure of the Mutant D206N of Phycoerythrobilin Synthase PebS from the Cyanophage P-SSM2 in complex with bound substrate Biliverdin IXA
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | ESRF BEAMLINE ID23-2 |
| Synchrotron site | ESRF |
| Beamline | ID23-2 |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2008-10-02 |
| Detector | MARRESEARCH |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 53.810, 63.150, 81.650 |
| Unit cell angles | 90.00, 108.53, 90.00 |
Refinement procedure
| Resolution | 39.687 - 1.850 |
| R-factor | 0.1586 |
| Rwork | 0.157 |
| R-free | 0.19320 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 2vgr |
| RMSD bond length | 0.016 |
| RMSD bond angle | 1.574 |
| Data reduction software | XDS |
| Data scaling software | XSCALE |
| Phasing software | MOLREP |
| Refinement software | PHENIX ((PHENIX.REFINE)) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 49.000 | 1.900 |
| High resolution limit [Å] | 1.850 | 1.850 |
| Rmerge | 0.080 | 0.450 |
| Number of reflections | 44404 | |
| <I/σ(I)> | 16.2 | 4.26 |
| Completeness [%] | 99.8 | 99.7 |
| Redundancy | 5.88 | 5.93 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | 170MM (NH4)2SO4, 20%PEG3350 |
