7U0B
Crystal structure of broadly neutralizing antibody HEPC3.1
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SSRL BEAMLINE BL12-2 |
Synchrotron site | SSRL |
Beamline | BL12-2 |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2018-07-19 |
Detector | DECTRIS PILATUS 6M |
Wavelength(s) | 0.98 |
Spacegroup name | I 21 3 |
Unit cell lengths | 171.613, 171.613, 171.613 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 60.674 - 2.790 |
R-factor | 0.2133 |
Rwork | 0.211 |
R-free | 0.24350 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 6med |
Data reduction software | MOSFLM |
Data scaling software | Aimless (0.7.2) |
Phasing software | PHASER |
Refinement software | PHENIX (1.13_2998) |
Data quality characteristics
Overall | Inner shell | Outer shell | |
Low resolution limit [Å] | 85.810 | 85.810 | 2.940 |
High resolution limit [Å] | 2.790 | 8.820 | 2.790 |
Rmerge | 0.218 | 0.064 | 6.447 |
Rmeas | 0.225 | 0.066 | 6.673 |
Rpim | 0.055 | 0.016 | 1.686 |
Total number of observations | 347747 | 12056 | 44582 |
Number of reflections | 21038 | 728 | 2982 |
<I/σ(I)> | 9.1 | 23.8 | 0.5 |
Completeness [%] | 99.7 | 99.9 | 97.7 |
Redundancy | 16.5 | 16.6 | 15 |
CC(1/2) | 0.998 | 0.999 | 0.318 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 298 | 2.0 M Ammonium sulfate |