7JQJ
Structure of W45F Glyoxylate/Hydroxypyruvate reductase A from Escherichia Coli in complex with NADP+
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | APS BEAMLINE 21-ID-D |
Synchrotron site | APS |
Beamline | 21-ID-D |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2020-03-12 |
Detector | DECTRIS EIGER X 9M |
Wavelength(s) | 1.12723 |
Spacegroup name | P 65 2 2 |
Unit cell lengths | 159.177, 159.177, 95.709 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 38.230 - 2.200 |
R-factor | 0.1861 |
Rwork | 0.186 |
R-free | 0.19490 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 7jqh |
RMSD bond length | 0.005 |
RMSD bond angle | 1.005 |
Data reduction software | HKL-2000 |
Data scaling software | HKL-2000 |
Phasing software | PHASER |
Refinement software | PHENIX (1.16_3549) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 38.230 | 2.283 |
High resolution limit [Å] | 2.200 | 2.204 |
Number of reflections | 35538 | 2919 |
<I/σ(I)> | 28.47 | |
Completeness [%] | 97.3 | |
Redundancy | 1.8 | |
CC(1/2) | 0.999 | 0.982 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 295 | 16% v/w PEG 4000, 20% v/v glycerol, 0.1 M sodium citrate pH 5.8 0.1 M ammonium sulfate |