29JO
Crystal structure of the unliganded PNGaseABif E236Q mutant
This is a non-PDB format compatible entry.
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | ALBA BEAMLINE XALOC |
| Synchrotron site | ALBA |
| Beamline | XALOC |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2025-12-12 |
| Detector | DECTRIS PILATUS 6M |
| Wavelength(s) | 0.97 |
| Spacegroup name | C 1 2 1 |
| Unit cell lengths | 85.417, 77.674, 80.212 |
| Unit cell angles | 90.00, 109.50, 90.00 |
Refinement procedure
| Resolution | 75.610 - 1.800 |
| R-factor | 0.20286 |
| Rwork | 0.201 |
| R-free | 0.24013 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.008 |
| RMSD bond angle | 1.660 |
| Data reduction software | XDS |
| Data scaling software | SCALA |
| Phasing software | PHASER |
| Refinement software | REFMAC (5.8.0430) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 75.610 | 1.900 |
| High resolution limit [Å] | 1.800 | 1.800 |
| Rmerge | 0.100 | 1.018 |
| Number of reflections | 40665 | 5595 |
| <I/σ(I)> | 7.7 | |
| Completeness [%] | 88.9 | |
| Redundancy | 3.8 | |
| CC(1/2) | 0.996 | 0.534 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 291 | peg 8000 AmSo4 |
