9N4H
YehD receptor binding domain S49A
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | ALS BEAMLINE 4.2.2 |
| Synchrotron site | ALS |
| Beamline | 4.2.2 |
| Temperature [K] | 100 |
| Detector technology | CMOS |
| Collection date | 2021-11-06 |
| Detector | NOIR-1 |
| Wavelength(s) | 1.072157 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 34.852, 92.296, 44.939 |
| Unit cell angles | 90.00, 91.69, 90.00 |
Refinement procedure
| Resolution | 46.148 - 1.650 |
| R-factor | 0.2039 |
| Rwork | 0.202 |
| R-free | 0.23800 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.014 |
| RMSD bond angle | 1.028 |
| Data reduction software | XDS |
| Data scaling software | XDS |
| Phasing software | PHENIX |
| Refinement software | PHENIX ((1.13_2998: ???)) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 46.150 | 1.709 |
| High resolution limit [Å] | 1.650 | 1.650 |
| Rmerge | 0.168 | 2.143 |
| Rmeas | 0.197 | 2.511 |
| Number of reflections | 33872 | 3066 |
| <I/σ(I)> | 8.02 | |
| Completeness [%] | 98.0 | 90.71 |
| Redundancy | 3.7 | 3.7 |
| CC(1/2) | 0.994 | 0.297 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 292 | 0.2 M MgFormate, 15% PEG 3350 |
