6J06
Crystal structure of intracellular B30.2 domain of BTN3A1 in complex with HMBPP-08
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | NSRRC BEAMLINE BL15A1 |
| Synchrotron site | NSRRC |
| Beamline | BL15A1 |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2018-01-02 |
| Detector | RAYONIX MX-300 |
| Wavelength(s) | 1.0 |
| Spacegroup name | P 21 21 2 |
| Unit cell lengths | 112.929, 211.588, 56.269 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 23.000 - 2.650 |
| R-factor | 0.17429 |
| Rwork | 0.172 |
| R-free | 0.22346 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 4n7u |
| RMSD bond length | 0.011 |
| RMSD bond angle | 1.425 |
| 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] | 23.000 | 2.740 |
| High resolution limit [Å] | 2.650 | 2.650 |
| Rmerge | 0.064 | |
| Number of reflections | 40042 | 3941 |
| <I/σ(I)> | 36.18 | |
| Completeness [%] | 99.8 | |
| Redundancy | 6.5 | |
| CC(1/2) | 0.923 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 298 | Lithium Sulfate monohydrate, tri-Sodium Citrate dihydrate, Ammonium Sulfate |
