6T94
NAD+-dependent fungal formate dehydrogenase from Chaetomium thermophilum: A complex of N120C mutant protein with the reduced form of the cofactor NADH.
This is a non-PDB format compatible entry.
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | DIAMOND BEAMLINE I03 |
Synchrotron site | Diamond |
Beamline | I03 |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2018-02-26 |
Detector | DECTRIS PILATUS3 6M |
Wavelength(s) | 0.9763 |
Spacegroup name | P 1 |
Unit cell lengths | 50.730, 94.745, 94.604 |
Unit cell angles | 85.96, 89.97, 81.58 |
Refinement procedure
Resolution | 68.900 - 1.150 |
Rwork | 0.196 |
R-free | 0.21790 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 5dna |
RMSD bond length | 0.012 |
RMSD bond angle | 1.812 |
Data reduction software | XDS |
Data scaling software | XDS |
Phasing software | MoRDa |
Refinement software | REFMAC (5.8.0257) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 68.900 | 1.170 |
High resolution limit [Å] | 1.150 | 1.150 |
Number of reflections | 536693 | 25189 |
<I/σ(I)> | 5.9 | 0.6 |
Completeness [%] | 86.9 | 82.3 |
Redundancy | 1.7 | 1.5 |
CC(1/2) | 0.998 | 0.325 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | MICROBATCH | 6.5 | 291 | 0.1 M Sodium cacodylate pH 6.5, 18 % w/v PEG 2000 MME |