6HCB
STRUCTURE OF GLUA2 LIGAND-BINDING DOMAIN (S1S2J-N775S) IN COMPLEX WITH GLUTAMATE AND TDPAM01 AT 1.9 A RESOLUTION.
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | MAX IV BEAMLINE BioMAX |
Synchrotron site | MAX IV |
Beamline | BioMAX |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2017-06-30 |
Detector | DECTRIS EIGER X 16M |
Wavelength(s) | 0.980 |
Spacegroup name | P 21 21 2 |
Unit cell lengths | 97.436, 122.025, 47.623 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 48.718 - 1.900 |
R-factor | 0.1703 |
Rwork | 0.169 |
R-free | 0.19180 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 5o9a |
RMSD bond length | 0.005 |
RMSD bond angle | 0.756 |
Data reduction software | XDS |
Data scaling software | SCALA (3.3.22) |
Phasing software | PHASER |
Refinement software | PHENIX (1.12_2829) |
Data quality characteristics
Overall | Inner shell | Outer shell | |
Low resolution limit [Å] | 48.720 | 48.718 | 2.000 |
High resolution limit [Å] | 1.900 | 6.010 | 1.900 |
Rmerge | 0.057 | 0.660 | |
Rmeas | 0.136 | 0.060 | 0.689 |
Rpim | 0.037 | 0.018 | 0.194 |
Number of reflections | 45663 | 1608 | 6551 |
<I/σ(I)> | 10.8 | 8.8 | 1 |
Completeness [%] | 100.0 | 99.8 | 100 |
Redundancy | 13.3 | 12 | 12.5 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 4.5 | 279 | 15% PEG4000, 0.1 M ammonium sulphate, 0.1 M phosphate citrate |