7P2Z
Crystal structure of human lysosomal acid-alpha-glucosidase, GAA, in complex with cyclosulfamidate 4
This is a non-PDB format compatible entry.
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SOLEIL BEAMLINE PROXIMA 2 |
| Synchrotron site | SOLEIL |
| Beamline | PROXIMA 2 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2019-09-21 |
| Detector | DECTRIS EIGER X 9M |
| Wavelength(s) | 0.9801 |
| Spacegroup name | P 21 21 21 |
| Unit cell lengths | 97.157, 102.539, 129.048 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 47.000 - 1.850 |
| R-factor | 0.14978 |
| Rwork | 0.148 |
| R-free | 0.17530 |
| Structure solution method | FOURIER SYNTHESIS |
| Starting model (for MR) | 5nn4 |
| RMSD bond length | 0.009 |
| RMSD bond angle | 1.513 |
| Data reduction software | XDS |
| Data scaling software | Aimless |
| Phasing software | REFMAC |
| Refinement software | REFMAC (5.8.0266) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 47.650 | 1.880 |
| High resolution limit [Å] | 1.850 | 1.850 |
| Rmerge | 0.121 | 1.554 |
| Rmeas | 0.130 | |
| Rpim | 0.049 | 0.628 |
| Number of reflections | 110461 | 5401 |
| <I/σ(I)> | 14.5 | 2.1 |
| Completeness [%] | 100.0 | 99.9 |
| Redundancy | 13.6 | |
| CC(1/2) | 0.998 | 0.742 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 7 | 293 | 1.9 M AMMONIUM SULPHATE, 0.1 M HEPES REMARK 280 PH 7.0, 2% V/V PEG400 |
