6RVZ
Crystal structure of ANGEL2, a 2',3'-cyclic phosphatase, in complex with adenosine-2',3'-vanadate
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SLS BEAMLINE X06DA |
| Synchrotron site | SLS |
| Beamline | X06DA |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2018-05-24 |
| Detector | DECTRIS PILATUS 2M-F |
| Wavelength(s) | 0.8000 |
| Spacegroup name | P 31 2 1 |
| Unit cell lengths | 99.653, 99.653, 94.155 |
| Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
| Resolution | 44.040 - 2.100 |
| R-factor | 0.18904 |
| Rwork | 0.188 |
| R-free | 0.21142 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | D_1292101550 |
| RMSD bond length | 0.003 |
| RMSD bond angle | 0.934 |
| Data reduction software | XDS |
| Data scaling software | XSCALE |
| Phasing software | PHASER |
| Refinement software | REFMAC (5.8.0238) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 44.040 | 2.180 |
| High resolution limit [Å] | 2.100 | 2.100 |
| Number of reflections | 31957 | 3173 |
| <I/σ(I)> | 8.12 | 0.91 |
| Completeness [%] | 100.0 | |
| Redundancy | 19.4 | |
| CC(1/2) | 0.993 | 0.357 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 7.5 | 293 | 0.1 M BIS-TRIS propane, pH 7.5, 0.2 M Potassium-Sodium Tartrate, 20% (w/v) PEG 3350 |
