7ORX
Rhodococcus jostii RHA1 thiamine diphosphate-dependent 4-hydroxybenzoylformate decarboxylase
This is a non-PDB format compatible entry.
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | DIAMOND BEAMLINE I03 |
Synchrotron site | Diamond |
Beamline | I03 |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2017-10-22 |
Detector | DECTRIS PILATUS 6M |
Wavelength(s) | 0.97948 |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 123.500, 132.240, 138.700 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 90.423 - 2.600 |
R-factor | 0.1963 |
Rwork | 0.195 |
R-free | 0.23290 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 6qsi |
RMSD bond length | 0.013 |
RMSD bond angle | 1.803 |
Data reduction software | XDS |
Data scaling software | XDS |
Phasing software | PHASER |
Refinement software | REFMAC (5.8.0258) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 123.500 | 2.740 |
High resolution limit [Å] | 2.600 | 2.600 |
Rmerge | 0.154 | 2.187 |
Number of reflections | 70459 | 10199 |
<I/σ(I)> | 11.5 | |
Completeness [%] | 100.0 | 100 |
Redundancy | 10 | 10.2 |
CC(1/2) | 0.997 | 0.461 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION | 6.5 | 300 | 0.16 M ammonium sulfate, 20% PEG8000, 0.1 mM Mes pH 6.5 |