6DS1
Crystal structure of Cj0485 dehydrogenase in complex with NADP+
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | ROTATING ANODE |
| Source details | RIGAKU MICROMAX-002 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2017-02-20 |
| Detector | DECTRIS PILATUS 200K |
| Wavelength(s) | 1.54187 |
| Spacegroup name | P 1 |
| Unit cell lengths | 68.504, 68.462, 70.718 |
| Unit cell angles | 89.31, 113.43, 115.67 |
Refinement procedure
| Resolution | 29.464 - 2.119 |
| R-factor | 0.1617 |
| Rwork | 0.159 |
| R-free | 0.21390 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 6drr |
| Data reduction software | HKL-2000 |
| Data scaling software | HKL-2000 |
| Phasing software | PHASER |
| Refinement software | PHENIX (1.13_2998) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 30.000 | 2.190 |
| High resolution limit [Å] | 2.119 | 2.150 |
| Rmerge | 0.116 | 0.385 |
| Rpim | 0.059 | 0.299 |
| Number of reflections | 57901 | |
| <I/σ(I)> | 11.3 | 2.4 |
| Completeness [%] | 95.7 | 95.7 |
| Redundancy | 3.8 | 2.2 |
| CC(1/2) | 0.991 | 0.770 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 8.5 | 291 | 23-26% PEG 4000, 0.08 M Tris, 0.15 M MgCl2 (H2O)6 and 20% glycerol |
