6AD5
Crystal Structure of HEWL in complex with TEMED (in the aroma form) after 24 hours under fibrillation conditions
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | ALBA BEAMLINE XALOC |
Synchrotron site | ALBA |
Beamline | XALOC |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2018-04-06 |
Detector | DECTRIS PILATUS 6M |
Wavelength(s) | 0.9792 |
Spacegroup name | P 43 21 2 |
Unit cell lengths | 78.939, 78.939, 36.970 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 55.820 - 1.750 |
R-factor | 0.14002 |
Rwork | 0.138 |
R-free | 0.18043 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 1dpx |
RMSD bond length | 0.023 |
RMSD bond angle | 2.182 |
Data reduction software | iMOSFLM |
Data scaling software | SCALA |
Phasing software | PHASER |
Refinement software | REFMAC (5.8.0135) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 55.820 | 1.840 |
High resolution limit [Å] | 1.750 | 1.750 |
Rmerge | 0.111 | |
Number of reflections | 12277 | |
<I/σ(I)> | 15.6 | |
Completeness [%] | 99.8 | |
Redundancy | 8.5 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 4.6 | 292 | 0.1 M sodium acetate pH 4.6 and 2 M NaCl |