9XW3
CspB from Mycobacterium tuberculosis
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SEALED TUBE |
| Source details | RIGAKU PhotonJet-S |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2025-10-16 |
| Detector | RIGAKU HyPix-3000 |
| Wavelength(s) | 1.54 |
| Spacegroup name | P 31 2 1 |
| Unit cell lengths | 91.573, 91.573, 59.805 |
| Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
| Resolution | 21.180 - 3.600 |
| R-factor | 0.22949 |
| Rwork | 0.225 |
| R-free | 0.34665 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | AF-I6WZM9-F1 |
| RMSD bond length | 0.006 |
| RMSD bond angle | 1.643 |
| Data reduction software | CrysalisPro |
| Data scaling software | CrysalisPro |
| Phasing software | PHASER |
| Refinement software | REFMAC (5.8.0430) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 80.000 | 3.730 |
| High resolution limit [Å] | 3.600 | 3.600 |
| Rmerge | 0.206 | 0.730 |
| Number of reflections | 3524 | 353 |
| <I/σ(I)> | 9.95 | |
| Completeness [%] | 99.2 | 100 |
| Redundancy | 7.4 | 7.9 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 7 | 298 | No.B5 of Nuc-Pro 3 (1.7 M lithium sulfate, 50 mM HEPES sodium salt, pH 7.0, 50 mM magnesium sulfate) (Jena Bioscience, Germany) |
