9SQJ
Crystal Structure of the MurT/GatD Enzyme Complex from Streptococcus pyogenes with bound AMPPNP
This is a non-PDB format compatible entry.
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | PETRA III, DESY BEAMLINE P11 |
| Synchrotron site | PETRA III, DESY |
| Beamline | P11 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2023-12-18 |
| Detector | DECTRIS EIGER2 X 16M |
| Wavelength(s) | 1.03321 |
| Spacegroup name | P 21 21 21 |
| Unit cell lengths | 88.289, 101.210, 177.296 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 49.112 - 1.981 |
| Rwork | 0.180 |
| R-free | 0.21730 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.009 |
| RMSD bond angle | 1.593 |
| Data reduction software | XDS |
| Data scaling software | XDS |
| Phasing software | PHASER |
| Refinement software | REFMAC (5.8.0258) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 49.112 | 2.051 |
| High resolution limit [Å] | 1.981 | 1.981 |
| Rmerge | 0.167 | |
| Rmeas | 0.176 | |
| Rpim | 0.054 | 0.703 |
| Number of reflections | 110500 | 10870 |
| <I/σ(I)> | 11.12 | 1.05 |
| Completeness [%] | 99.5 | 99.14 |
| Redundancy | 10.3 | 10.1 |
| CC(1/2) | 0.998 | 0.474 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 7 | 277 | 17% (w/v) PEG 3350 0.2 M HEPES pH 7.0 0.2 M NaCl |
