4KYH
Crystal structure of mouse glyoxalase I complexed with zopolrestat
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SEALED TUBE |
| Source details | OXFORD DIFFRACTION ENHANCE ULTRA |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2012-12-27 |
| Detector | OXFORD ONYX CCD |
| Wavelength(s) | 1.5418 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 41.781, 64.716, 65.361 |
| Unit cell angles | 90.00, 101.90, 90.00 |
Refinement procedure
| Resolution | 24.690 - 2.500 |
| R-factor | 0.17498 |
| Rwork | 0.172 |
| R-free | 0.23647 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.016 |
| RMSD bond angle | 1.731 |
| Data reduction software | CrysalisPro |
| Data scaling software | SCALA |
| Phasing software | MOLREP |
| Refinement software | REFMAC (5.5.0102) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 25.840 | 2.589 |
| High resolution limit [Å] | 2.500 | 2.500 |
| Rmerge | 0.058 | 0.181 |
| Number of reflections | 11553 | |
| <I/σ(I)> | 5.53 | |
| Completeness [%] | 97.1 | 97.46 |
| Redundancy | 3 | 3 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 5.8 | 289 | 30% PEG 2000, 50mM MES, 0.1M NaCl, pH 5.8, VAPOR DIFFUSION, HANGING DROP, temperature 289K |
