7XIN
Crystal structure of DODC from Pseudomonas
Experimental procedure
| Experimental method | MAD |
| Source type | SYNCHROTRON |
| Source details | SSRF BEAMLINE BL19U1 |
| Synchrotron site | SSRF |
| Beamline | BL19U1 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2019-06-07 |
| Detector | DECTRIS PILATUS3 6M |
| Wavelength(s) | 0.987 |
| Spacegroup name | P 1 |
| Unit cell lengths | 57.767, 67.014, 168.576 |
| Unit cell angles | 90.27, 92.38, 90.36 |
Refinement procedure
| Resolution | 43.593 - 2.000 |
| R-factor | 0.4755 |
| Rwork | 0.473 |
| R-free | 0.52060 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 4x3p |
| Data reduction software | xia2 |
| Data scaling software | HKL-2000 |
| Phasing software | PHENIX |
| Refinement software | REFMAC (5.8.0123) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 84.214 | 2.330 |
| High resolution limit [Å] | 2.000 | 2.270 |
| Rmerge | 0.124 | 0.377 |
| Rmeas | 0.135 | 0.409 |
| Rpim | 0.052 | 0.157 |
| Number of reflections | 137467 | 10325 |
| <I/σ(I)> | 121077 | |
| Completeness [%] | 71.0 | |
| Redundancy | 6.8 | |
| CC(1/2) | 0.992 | 0.949 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 6.5 | 289 | 0.35M Sodium acetate trihydrate,0.15M Sodium cacodylate trihydrate,30% w/v Polyethylene glycol 4000 |
