3ZCW
Eg5 - New allosteric binding site
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | DIAMOND BEAMLINE I02 |
| Synchrotron site | Diamond |
| Beamline | I02 |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2011-09-18 |
| Detector | ADSC QUANTUM 315r |
| Spacegroup name | C 1 2 1 |
| Unit cell lengths | 107.940, 62.890, 75.050 |
| Unit cell angles | 90.00, 117.46, 90.00 |
Refinement procedure
| Resolution | 28.468 - 1.691 |
| R-factor | 0.196 |
| Rwork | 0.194 |
| R-free | 0.23280 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 2wog |
| RMSD bond length | 0.011 |
| RMSD bond angle | 1.414 |
| Data reduction software | XDS |
| Data scaling software | SCALA |
| Phasing software | MOLREP |
| Refinement software | PHENIX ((PHENIX.REFINE)) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 36.960 | 1.780 |
| High resolution limit [Å] | 1.690 | 1.690 |
| Rmerge | 0.080 | 0.660 |
| Number of reflections | 49475 | |
| <I/σ(I)> | 9.3 | 2 |
| Completeness [%] | 99.2 | 99.2 |
| Redundancy | 3.9 | 3.9 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | 6.9 | 20% PEG3350, 2MM MAGNESIUM CHLORIDE, 100MM HEPES PH 7.5 |
