7Y8D
Crystal structure of cp1 bound BCLxl
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SSRF BEAMLINE BL19U1 |
Synchrotron site | SSRF |
Beamline | BL19U1 |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2020-04-19 |
Detector | DECTRIS PILATUS 6M |
Wavelength(s) | 0.987 |
Spacegroup name | C 2 2 21 |
Unit cell lengths | 69.803, 99.366, 51.359 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 49.730 - 2.000 |
R-factor | 0.1903 |
Rwork | 0.188 |
R-free | 0.24310 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | AF2 |
RMSD bond length | 0.011 |
RMSD bond angle | 1.910 |
Data reduction software | HKL-3000 |
Data scaling software | HKL-2000 |
Phasing software | REFMAC |
Refinement software | REFMAC (5.8.0267) |
Data quality characteristics
Overall | Inner shell | Outer shell | |
Low resolution limit [Å] | 50.000 | 50.000 | 2.030 |
High resolution limit [Å] | 2.000 | 5.430 | 2.000 |
Rmerge | 0.070 | 0.029 | 0.663 |
Rmeas | 0.073 | 0.030 | 0.693 |
Rpim | 0.020 | 0.008 | 0.197 |
Total number of observations | 156882 | ||
Number of reflections | 12248 | 678 | 597 |
<I/σ(I)> | 7.1 | ||
Completeness [%] | 98.2 | 98.1 | 95.7 |
Redundancy | 12.8 | 12 | 11.7 |
CC(1/2) | 1.000 | 0.907 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION | 7.5 | 277 | 0.1M HEPES pH7.5, 2.0M Ammonium formate |