8TBP
HLA-DRB1*15:01 in complex with smith antigen
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | AUSTRALIAN SYNCHROTRON BEAMLINE MX2 |
Synchrotron site | Australian Synchrotron |
Beamline | MX2 |
Temperature [K] | 77 |
Detector technology | CCD |
Collection date | 2022-08-20 |
Detector | ADSC QUANTUM 315r |
Wavelength(s) | 0.95373 |
Spacegroup name | P 43 21 2 |
Unit cell lengths | 95.080, 95.080, 294.200 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 46.931 - 3.126 |
R-factor | 0.205258999018 |
Rwork | 0.203 |
R-free | 0.25340 |
Structure solution method | MOLECULAR REPLACEMENT |
RMSD bond length | 0.004 |
RMSD bond angle | 0.732 |
Data reduction software | XDS |
Data scaling software | SCALA |
Phasing software | PHASER |
Refinement software | PHENIX (1.10.1_2155) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 46.931 | 3.330 |
High resolution limit [Å] | 3.120 | 3.120 |
Rpim | 0.136 | |
Number of reflections | 24942 | 4343 |
<I/σ(I)> | 7.7 | 1.8 |
Completeness [%] | 99.6 | |
Redundancy | 16 | |
CC(1/2) | 0.989 | 0.736 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 289.15 | 0.2M Disodium Malon 20% w/v PEG 3350 |