9L4T
The crystal structure of BurB-Met complex
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SSRF BEAMLINE BL17U1 |
| Synchrotron site | SSRF |
| Beamline | BL17U1 |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2023-07-12 |
| Detector | ADSC QUANTUM 315r |
| Wavelength(s) | 0.9792 |
| Spacegroup name | C 1 2 1 |
| Unit cell lengths | 122.954, 67.416, 59.251 |
| Unit cell angles | 90.00, 117.48, 90.00 |
Refinement procedure
| Resolution | 34.770 - 2.160 |
| R-factor | 0.2041 |
| Rwork | 0.202 |
| R-free | 0.24360 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.008 |
| RMSD bond angle | 1.033 |
| Data reduction software | HKL-3000 |
| Data scaling software | HKL-3000 |
| Phasing software | PHASER |
| Refinement software | PHENIX ((1.19.2_4158: ???)) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 50.000 | 2.190 |
| High resolution limit [Å] | 2.150 | 2.150 |
| Rmerge | 0.117 | 0.365 |
| Rmeas | 0.145 | 0.422 |
| Rpim | 0.059 | 0.174 |
| Number of reflections | 22851 | 2159 |
| <I/σ(I)> | 27 | 3.6 |
| Completeness [%] | 99.3 | 96.9 |
| Redundancy | 6.2 | 5.3 |
| CC(1/2) | 0.985 | 0.910 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 291 | 0.2 M ammonium sulfate, 0.1 M Tris pH 8.5, 15% (w/v) polyethylene glycol (PEG) 8000 |
