3APY
Properties and crystal structure of methylenetetrahydrofolate reductase from Thermus thermophilus HB8
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | PHOTON FACTORY BEAMLINE AR-NW12A |
Synchrotron site | Photon Factory |
Beamline | AR-NW12A |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2010-06-29 |
Detector | ADSC QUANTUM 210r |
Wavelength(s) | 1.0 |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 116.588, 90.930, 125.152 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 19.960 - 2.800 |
R-factor | 0.20869 |
Rwork | 0.204 |
R-free | 0.30586 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 1v93 |
RMSD bond length | 0.014 |
RMSD bond angle | 1.572 |
Data reduction software | DENZO |
Data scaling software | HKL-2000 |
Phasing software | MOLREP (10.2.31) |
Refinement software | REFMAC (5.5.0102) |
Data quality characteristics
Overall | |
Low resolution limit [Å] | 19.960 |
High resolution limit [Å] | 2.570 |
Number of reflections | 72447 |
Completeness [%] | 91.5 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 8 | 293 | 0.1M Tris-HCl, 0.2M Ammonium Sulfate, 20-25% PEG 4000, 5% GLYCEROL , pH 8.0, VAPOR DIFFUSION, HANGING DROP, temperature 293K |