2PTF
Crystal structure of protein MTH_863 from Methanobacterium thermoautotrophicum bound to FMN
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | NSLS BEAMLINE X29A |
Synchrotron site | NSLS |
Beamline | X29A |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2007-05-04 |
Detector | ADSC QUANTUM 315 |
Wavelength(s) | 0.9791 |
Spacegroup name | P 41 21 2 |
Unit cell lengths | 91.727, 91.727, 117.868 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 20.000 - 2.350 |
R-factor | 0.201 |
Rwork | 0.199 |
R-free | 0.25300 |
Structure solution method | SAD |
RMSD bond length | 0.018 |
RMSD bond angle | 1.568 |
Data reduction software | DENZO |
Data scaling software | SCALA |
Phasing software | SHELXCD |
Refinement software | REFMAC |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 45.883 | 2.480 |
High resolution limit [Å] | 2.350 | 2.350 |
Rmerge | 0.087 | 0.413 |
Number of reflections | 21594 | |
<I/σ(I)> | 26 | 5.9 |
Completeness [%] | 99.9 | 100 |
Redundancy | 12.5 | 12.8 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION | 8.5 | 294 | 100 mM Tris-HCl, 50% MPD, 100 mM Ammonium phosphate, pH 8.5, VAPOR DIFFUSION, temperature 294K |