9N58
Structure of the PTP-like myo-inositol phosphatase from Solidesulfovibrio magneticus in complex with myo-inositol hexakisphosphate
Replaces: 7K6WExperimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SEALED TUBE |
| Source details | RIGAKU MICROMAX-003 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2021-07-27 |
| Detector | DECTRIS PILATUS 200K |
| Wavelength(s) | 1.5418 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 70.019, 97.339, 104.055 |
| Unit cell angles | 90.00, 92.58, 90.00 |
Refinement procedure
| Resolution | 24.550 - 2.050 |
| R-factor | 0.1806 |
| Rwork | 0.180 |
| R-free | 0.20770 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.002 |
| RMSD bond angle | 0.550 |
| Data reduction software | CrysalisPro (41.110a) |
| Data scaling software | CrysalisPro (41.110a) |
| Phasing software | MOLREP (1.19.2_4158) |
| Refinement software | PHENIX (1.19.2_4158) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 24.550 | 2.120 |
| High resolution limit [Å] | 2.050 | 2.050 |
| Rmerge | 0.090 | 0.322 |
| Number of reflections | 86432 | 8645 |
| <I/σ(I)> | 11.84 | |
| Completeness [%] | 98.8 | 97.8 |
| Redundancy | 3 | 2.8 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 4.7 | 293 | PEG 4000 and 1000, 2-methyl-2,4-pentanediol, carboxylates, sodium acetate |
