2RG7
Apo- Crystal Structure of a Periplasmic Heme Binding Protein from Shigella dysenteriae
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SSRL BEAMLINE BL9-2 |
Synchrotron site | SSRL |
Beamline | BL9-2 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2006-06-02 |
Detector | MARMOSAIC 325 mm CCD |
Wavelength(s) | 1.00 |
Spacegroup name | P 1 |
Unit cell lengths | 54.817, 73.280, 72.380 |
Unit cell angles | 71.44, 77.80, 89.90 |
Refinement procedure
Resolution | 35.900 - 2.050 |
R-factor | 0.232 |
Rwork | 0.232 |
R-free | 0.27400 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 2r7a |
RMSD bond length | 0.006 |
RMSD bond angle | 1.200 |
Data reduction software | HKL-2000 |
Data scaling software | HKL-2000 |
Phasing software | PHASER |
Refinement software | CNS (1.2) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 35.900 | 2.090 |
High resolution limit [Å] | 2.050 | 2.050 |
Rmerge | 0.057 | 0.666 |
Number of reflections | 63384 | |
<I/σ(I)> | 27.19 | 2.01 |
Completeness [%] | 98.0 | 97 |
Redundancy | 3.9 | 3.9 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 4 | 298 | 0.1m SODIUM CITRATE, 0.05m AMMONIUM BROMIDE, 15% POLYETHYLENE GLYCOL 4000, pH 4.0, VAPOR DIFFUSION, HANGING DROP, temperature 298K |