7PS3
Crystal structure of antibody Beta-32 Fab
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | DIAMOND BEAMLINE I03 |
Synchrotron site | Diamond |
Beamline | I03 |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2021-07-28 |
Detector | DECTRIS EIGER2 XE 16M |
Wavelength(s) | 0.97625 |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 60.583, 66.848, 135.015 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 47.500 - 1.700 |
R-factor | 0.1688 |
Rwork | 0.168 |
R-free | 0.18840 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 7beh |
RMSD bond length | 0.006 |
RMSD bond angle | 0.831 |
Data reduction software | xia2 |
Data scaling software | xia2 |
Phasing software | PHASER |
Refinement software | PHENIX (1.19_4092) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 68.000 | 1.730 |
High resolution limit [Å] | 1.700 | 1.700 |
Rmerge | 0.181 | |
Rpim | 0.027 | |
Number of reflections | 61012 | 2917 |
<I/σ(I)> | 13.4 | 0.5 |
Completeness [%] | 99.9 | 96.4 |
Redundancy | 43.4 | 17.7 |
CC(1/2) | 0.999 | 0.705 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 293 | 2.1 M DL-Malic acid pH 7.0 |