8BR9
Stapled peptide SP24 in complex with humanised RadA mutant HumRadA22
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | DIAMOND BEAMLINE I04 |
Synchrotron site | Diamond |
Beamline | I04 |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2021-01-19 |
Detector | DECTRIS EIGER2 X 16M |
Wavelength(s) | 0.9795 |
Spacegroup name | P 21 21 2 |
Unit cell lengths | 140.464, 38.642, 43.528 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 43.530 - 1.630 |
R-factor | 0.2515 |
Rwork | 0.250 |
R-free | 0.28160 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 6hqu |
RMSD bond length | 0.013 |
RMSD bond angle | 1.604 |
Data reduction software | XDS |
Data scaling software | Aimless |
Phasing software | PHASER |
Refinement software | BUSTER |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 70.230 | 1.660 |
High resolution limit [Å] | 1.630 | 1.630 |
Rmeas | 0.059 | |
Number of reflections | 30303 | 11733 |
<I/σ(I)> | 12 | 0.3 |
Completeness [%] | 98.7 | |
Redundancy | 7.9 | |
CC(1/2) | 1.000 | 0.300 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 291.15 | 0.1 M Na 3 Cit 4.2 pH (Buffer) 20 %w/v PEG 1K (Precipitant) 0.2 M Li 2 SO4 (Salt) |