6T9W
Crystal structure of formate dehydrogenase FDH2 D222A/Q223R enzyme from Granulicella mallensis MP5ACTX8 in complex with NADP and azide.
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | ELETTRA BEAMLINE 11.2C |
| Synchrotron site | ELETTRA |
| Beamline | 11.2C |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2019-02-07 |
| Detector | DECTRIS PILATUS3 S 6M |
| Wavelength(s) | 0.98 |
| Spacegroup name | C 1 2 1 |
| Unit cell lengths | 126.530, 62.080, 211.745 |
| Unit cell angles | 90.00, 91.25, 90.00 |
Refinement procedure
| Resolution | 54.100 - 2.150 |
| Rwork | 0.191 |
| R-free | 0.23070 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 6t8c |
| Data reduction software | XDS |
| Data scaling software | Aimless |
| Phasing software | PHASER |
| Refinement software | PHENIX (1.13-2998) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 70.650 | 70.560 |
| High resolution limit [Å] | 2.150 | 2.150 |
| Rmerge | 0.109 | 0.709 |
| Number of reflections | 153758 | 3923 |
| <I/σ(I)> | 7.3 | 2 |
| Completeness [%] | 99.1 | |
| Redundancy | 4.6 | |
| CC(1/2) | 0.991 | 0.683 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 5 | 293 | 0.1 M Citrate pH 5.0, 20 % w/v PEG 6000 |
