6MGR
Crystal Structure of the Catalytic Domain of the Inosine Monophosphate Dehydrogenase from Campylobacter jejuni in the complex with inhibitor Oxanosine monophosphate
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | APS BEAMLINE 19-ID |
| Synchrotron site | APS |
| Beamline | 19-ID |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2017-03-29 |
| Detector | DECTRIS PILATUS3 S 6M |
| Wavelength(s) | 0.97924 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 69.343, 119.592, 119.307 |
| Unit cell angles | 90.00, 89.99, 90.00 |
Refinement procedure
| Resolution | 45.284 - 1.970 |
| R-factor | 0.1749 |
| Rwork | 0.173 |
| R-free | 0.20180 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | PDBID 5URQ |
| RMSD bond length | 0.007 |
| RMSD bond angle | 0.960 |
| Data reduction software | HKL-3000 |
| Data scaling software | HKL-3000 |
| Phasing software | HKL-3000 |
| Refinement software | PHENIX ((1.13_2998)) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 50.000 | 2.000 |
| High resolution limit [Å] | 1.970 | 1.970 |
| Rmerge | 0.131 | 0.876 |
| Number of reflections | 135052 | 5909 |
| <I/σ(I)> | 17 | 1 |
| Completeness [%] | 98.2 | 86.7 |
| Redundancy | 5.7 | 4.1 |
| CC(1/2) | 0.591 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 6 | 289 | 0.2 M Lithium Sulfate, 0.1 M MES:NaOH pH 6, 35% (v/v) MPD |
