5ZXK
Crystal structure of intracellular B30.2 domain of BTN3A1 in complex with HMBPP
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | NSRRC BEAMLINE BL13C1 |
| Synchrotron site | NSRRC |
| Beamline | BL13C1 |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2016-08-10 |
| Detector | ADSC QUANTUM 315r |
| Wavelength(s) | 1 |
| Spacegroup name | P 21 21 2 |
| Unit cell lengths | 45.131, 125.668, 39.046 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 25.000 - 1.960 |
| R-factor | 0.209 |
| Rwork | 0.206 |
| R-free | 0.26500 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 4n7u |
| RMSD bond length | 0.019 |
| RMSD bond angle | 1.972 |
| Data reduction software | HKL-2000 |
| Data scaling software | HKL-2000 |
| Phasing software | PHASER |
| Refinement software | REFMAC (5.8.0103) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 25.000 | 2.080 |
| High resolution limit [Å] | 1.960 | 1.960 |
| Rmerge | 0.084 | 0.409 |
| Number of reflections | 16009 | |
| <I/σ(I)> | 17.99 | |
| Completeness [%] | 96.9 | 96.6 |
| Redundancy | 3.3 | 3.4 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 289 | CALCIUM ACETATE HYDRATE, PEG8000, SODIUM CACODYLATE |
