5EEQ
Grb7 SH2 with the G7-B1 bicyclic peptide inhibitor
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | AUSTRALIAN SYNCHROTRON BEAMLINE MX2 |
Synchrotron site | Australian Synchrotron |
Beamline | MX2 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2010-10-16 |
Detector | ADSC QUANTUM 315r |
Wavelength(s) | 0.954 |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 37.081, 63.811, 52.040 |
Unit cell angles | 90.00, 92.50, 90.00 |
Refinement procedure
Resolution | 40.306 - 1.600 |
R-factor | 0.1746 |
Rwork | 0.173 |
R-free | 0.19610 |
RMSD bond length | 0.005 |
RMSD bond angle | 0.935 |
Data reduction software | XDS |
Data scaling software | SCALA |
Phasing software | MOLREP |
Refinement software | PHENIX (1.9_1692) |
Data quality characteristics
Overall | |
Low resolution limit [Å] | 40.310 |
High resolution limit [Å] | 1.600 |
Number of reflections | 31961 |
Completeness [%] | 99.8 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 293 | 0.1 M bis-tris pH 5.5, 25% (w/v) PEG 3350 |