1Z69
Crystal structure of methylenetetrahydromethanopterin reductase (Mer) in complex with coenzyme F420
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | ESRF BEAMLINE ID29 |
Synchrotron site | ESRF |
Beamline | ID29 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2004-02-09 |
Detector | ADSC QUANTUM 4 |
Wavelength(s) | 0.9792 |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 81.810, 83.410, 99.170 |
Unit cell angles | 90.00, 91.15, 90.00 |
Refinement procedure
Resolution | 19.950 - 2.610 |
R-factor | 0.1851 |
Rwork | 0.185 |
R-free | 0.22200 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 1f07 |
RMSD bond length | 0.012 |
RMSD bond angle | 1.600 |
Data reduction software | DENZO |
Data scaling software | XDS |
Phasing software | EPMR |
Refinement software | CNS (1.1) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 30.000 | 2.740 |
High resolution limit [Å] | 2.600 | 2.600 |
Rmerge | 0.085 | 0.214 |
Number of reflections | 40607 | |
<I/σ(I)> | 14.2 | 6.8 |
Completeness [%] | 97.1 | 86.4 |
Redundancy | 3.96 | 3.6 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 8.5 | 281 | Tris/HCl, PEG 4000, Isopropanol, pH 8.5, VAPOR DIFFUSION, HANGING DROP, temperature 281K |