7UM3
Crystal structure of a Fab in complex with a peptide derived from the LAG-3 D1 domain loop insertion
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | APS BEAMLINE 17-ID |
Synchrotron site | APS |
Beamline | 17-ID |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2017-12-13 |
Detector | DECTRIS EIGER X 9M |
Wavelength(s) | 1.0 |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 64.238, 112.620, 125.619 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 83.855 - 2.398 |
R-factor | 0.2088 |
Rwork | 0.206 |
R-free | 0.26490 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 4nm4 |
RMSD bond length | 0.009 |
RMSD bond angle | 1.054 |
Data reduction software | XDS |
Data scaling software | XSCALE |
Phasing software | PHASER |
Refinement software | PHENIX (1.17_3644) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 83.855 | 2.460 |
High resolution limit [Å] | 2.398 | 2.400 |
Number of reflections | 36288 | 2480 |
<I/σ(I)> | 6 | |
Completeness [%] | 99.5 | |
Redundancy | 6.3 | |
CC(1/2) | 0.860 | 0.780 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 298 | 0.1 M Bis-Tris, pH 5.5, 25% PEG3350 |