6MHR
Structure of the human 4-1BB / Urelumab Fab complex
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | ALS BEAMLINE 5.0.2 |
Synchrotron site | ALS |
Beamline | 5.0.2 |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2016-12-21 |
Detector | DECTRIS PILATUS3 6M |
Wavelength(s) | 1.1271 |
Spacegroup name | C 2 2 21 |
Unit cell lengths | 77.148, 192.058, 344.581 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 49.649 - 2.800 |
R-factor | 0.2005 |
Rwork | 0.200 |
R-free | 0.22200 |
Structure solution method | MOLECULAR REPLACEMENT |
Data reduction software | XDS |
Data scaling software | Aimless (0.5.29) |
Phasing software | PHASER |
Refinement software | PHENIX (1.14_3260) |
Data quality characteristics
Overall | Inner shell | Outer shell | |
Low resolution limit [Å] | 49.650 | 49.650 | 2.870 |
High resolution limit [Å] | 2.800 | 12.830 | 2.800 |
Rmerge | 0.223 | 0.044 | 4.712 |
Rmeas | 0.227 | 0.045 | 4.797 |
Rpim | 0.044 | 0.010 | 0.896 |
Number of reflections | 63589 | 738 | 4416 |
<I/σ(I)> | 15.8 | ||
Completeness [%] | 100.0 | 98.6 | 100 |
Redundancy | 26.7 | 19.9 | 28 |
CC(1/2) | 0.998 | 0.997 | 0.312 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 7 | 295 | 1M sodium malonate, pH 7.0, 0.4% v/v Jeffamine ED-2001 pH7.0, 0.1M HEPES pH7.0 |