9UP6
Klebsiella pneumoniae NagA
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | PAL/PLS BEAMLINE 5C (4A) |
| Synchrotron site | PAL/PLS |
| Beamline | 5C (4A) |
| Temperature [K] | 125 |
| Detector technology | PIXEL |
| Collection date | 2021-05-06 |
| Detector | DECTRIS EIGER X 9M |
| Wavelength(s) | 1.000 |
| Spacegroup name | P 1 |
| Unit cell lengths | 73.520, 73.700, 157.070 |
| Unit cell angles | 83.70, 88.96, 82.69 |
Refinement procedure
| Resolution | 29.440 - 3.670 |
| R-factor | 0.2232 |
| Rwork | 0.221 |
| R-free | 0.26780 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.003 |
| RMSD bond angle | 0.619 |
| Data reduction software | XDS |
| Data scaling software | XDS |
| Phasing software | PHENIX |
| Refinement software | PHENIX (1.19.1_4122) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 29.440 | 3.801 |
| High resolution limit [Å] | 3.670 | 3.670 |
| Number of reflections | 34506 | 3430 |
| <I/σ(I)> | 8.9 | |
| Completeness [%] | 97.0 | |
| Redundancy | 3.5 | |
| CC(1/2) | 0.993 | 0.692 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 293.15 | 22% (w/v) PEG 3350, 0.25M Potassium formate, 0.01M Strontium chloride hexahydrate |
