4OFN
Monoclinic NaGST1
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SEALED TUBE |
Source details | OXFORD DIFFRACTION ENHANCE ULTRA |
Detector technology | CCD |
Spacegroup name | C 1 2 1 |
Unit cell lengths | 84.554, 45.213, 113.763 |
Unit cell angles | 90.00, 112.11, 90.00 |
Refinement procedure
Resolution | 14.850 - 2.690 |
R-factor | 0.29436 |
Rwork | 0.292 |
R-free | 0.33036 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 2on7 |
RMSD bond length | 0.006 |
RMSD bond angle | 0.971 |
Data reduction software | CrysalisPro (Pro) |
Data scaling software | SCALA |
Phasing software | PHASER |
Refinement software | REFMAC (5.8.0049) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 105.400 | 2.850 |
High resolution limit [Å] | 2.690 | 2.690 |
Rmerge | 0.095 | |
Number of reflections | 10767 | |
<I/σ(I)> | 8.3 | 4.4 |
Completeness [%] | 97.1 | 97.7 |
Redundancy | 2.6 | 2.1 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 4.6 | 298 | 0.1 M sodium acetate, pH 4.6, 30% PEG 400, 100mM protoporphyrin IX disodium salt, VAPOR DIFFUSION, SITTING DROP, temperature 298K |