8ALS
The apo-crystal structure of a variant form of the 28-kDa Schistosoma haematobium glutathione transferase
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SEALED TUBE |
| Source details | BRUKER IMUS 3.0 MICROFOCUS |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2022-05-18 |
| Detector | Bruker PHOTON III |
| Wavelength(s) | 1.5418 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 54.133, 77.086, 54.015 |
| Unit cell angles | 90.00, 93.15, 90.00 |
Refinement procedure
| Resolution | 24.678 - 2.300 |
| R-factor | 0.2168 |
| Rwork | 0.215 |
| R-free | 0.24480 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 1oe8 |
| RMSD bond length | 0.002 |
| RMSD bond angle | 0.506 |
| Data reduction software | SAINT |
| Data scaling software | SADABS |
| Phasing software | PHASER |
| Refinement software | PHENIX ((1.15.2_3472: ???)) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 24.680 | 2.380 |
| High resolution limit [Å] | 2.300 | 2.300 |
| Rmerge | 0.132 | 0.600 |
| Number of reflections | 19612 | 1752 |
| <I/σ(I)> | 11.4 | 3.4 |
| Completeness [%] | 98.8 | 89.9 |
| Redundancy | 8.1 | 6.1 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 7.5 | 293 | 5.3 mg/ml of Sh28GST in 25mM of sodium phosphate buffer (NaH2PO4) at 7.5 pH with the crystallization condition consisting of 2.1 M ammonium sulfate, 100 mM Tris (pH 7.5), and 5 mM B-mercaptoethanol |
