4ZXL
CpOGA D298N in complex with Drosophila HCF -derived Thr-O-GlcNAc peptide
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | ESRF BEAMLINE ID23-1 |
| Synchrotron site | ESRF |
| Beamline | ID23-1 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2015-02-21 |
| Detector | PSI PILATUS 6M |
| Wavelength(s) | 0.8729 |
| Spacegroup name | P 61 |
| Unit cell lengths | 118.560, 118.560, 148.441 |
| Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
| Resolution | 34.900 - 2.600 |
| R-factor | 0.17155 |
| Rwork | 0.171 |
| R-free | 0.22010 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 2yds |
| RMSD bond length | 0.006 |
| RMSD bond angle | 1.007 |
| Data reduction software | XDS |
| Data scaling software | SCALA |
| Phasing software | MOLREP |
| Refinement software | REFMAC (5.6.0117) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 34.900 | 2.720 |
| High resolution limit [Å] | 2.600 | 2.600 |
| Rmerge | 0.152 | 0.862 |
| Number of reflections | 36087 | |
| <I/σ(I)> | 7.3 | |
| Completeness [%] | 99.4 | 99 |
| Redundancy | 3.3 | 3.3 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 295.15 | CpOGA D298N was concentrated to 35 mg/ml in 25 mM Tris/HCl (pH 8.0) and crystallized from 0.175 M CdSO4 and 0.6 M sodium acetate pH 7.5 |
