8W9G
Hepatitis B virus core protein Y132A mutant in complex with CBT-078
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SPRING-8 BEAMLINE BL26B2 |
| Synchrotron site | SPring-8 |
| Beamline | BL26B2 |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2018-05-17 |
| Detector | RAYONIX MX225-HS |
| Wavelength(s) | 1.0 |
| Spacegroup name | P 1 |
| Unit cell lengths | 63.790, 67.660, 85.030 |
| Unit cell angles | 68.26, 69.71, 83.01 |
Refinement procedure
| Resolution | 43.500 - 2.600 |
| Rwork | 0.191 |
| R-free | 0.23600 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 5e0i |
| Data reduction software | XDS |
| Data scaling software | SCALA |
| Phasing software | PHASER |
| Refinement software | PHENIX (1.18.2) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 43.500 | 2.760 |
| High resolution limit [Å] | 2.600 | 2.600 |
| Number of reflections | 37298 | 3485 |
| <I/σ(I)> | 12.12 | 2.25 |
| Completeness [%] | 97.9 | 93.9 |
| Redundancy | 3.93 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 5.7 | 293 | 0.1M sodium citrate (pH 5.7), 13% (v/v) 2-propanol, and 2% PEG10000 |
