5NHS
The crystal structure of Xanthomonas albilineans N5, N10-methylenetetrahydrofolate dehydrogenase-cyclohydrolase (FolD)
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | LNLS BEAMLINE W01B-MX2 |
Synchrotron site | LNLS |
Beamline | W01B-MX2 |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2014-11-27 |
Detector | DECTRIS PILATUS 2M |
Wavelength(s) | 1.45864 |
Spacegroup name | P 21 21 2 |
Unit cell lengths | 123.295, 76.404, 66.641 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 66.640 - 2.110 |
R-factor | 0.19358 |
Rwork | 0.191 |
R-free | 0.24054 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 1b0a |
RMSD bond length | 0.023 |
RMSD bond angle | 2.148 |
Data reduction software | XDS |
Data scaling software | Aimless |
Phasing software | PHASER |
Refinement software | REFMAC (5.8.0158) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 66.640 | 2.170 |
High resolution limit [Å] | 2.110 | 2.110 |
Rmerge | 0.100 | 0.970 |
Number of reflections | 36804 | |
<I/σ(I)> | 1.45 | 1.5 |
Completeness [%] | 99.2 | 94.6 |
Redundancy | 2 | 4 |
CC(1/2) | 0.470 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION | 6.5 | 291 | 0.15 M malic acid, 20% PEG 3350, 0.1 M sodium cacodylate pH 6.5 |