7WT2
human glyoxalase I in complex with TLSC702
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | PHOTON FACTORY BEAMLINE BL-17A |
Synchrotron site | Photon Factory |
Beamline | BL-17A |
Temperature [K] | 95 |
Detector technology | PIXEL |
Collection date | 2020-10-29 |
Detector | DECTRIS EIGER X 16M |
Wavelength(s) | 0.98000 |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 53.691, 82.532, 45.281 |
Unit cell angles | 90.00, 93.85, 90.00 |
Refinement procedure
Resolution | 19.810 - 2.000 |
R-factor | 0.1873 |
Rwork | 0.183 |
R-free | 0.22830 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 3vw9 |
RMSD bond length | 0.008 |
RMSD bond angle | 1.468 |
Data reduction software | XDS |
Data scaling software | SCALA |
Phasing software | MOLREP |
Refinement software | REFMAC (5.8.0258) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 20.000 | 2.110 |
High resolution limit [Å] | 2.000 | 2.000 |
Rmerge | 0.049 | 0.262 |
Number of reflections | 25974 | 3727 |
<I/σ(I)> | 13.9 | 4 |
Completeness [%] | 96.9 | 97 |
Redundancy | 3.5 | |
CC(1/2) | 0.999 | 0.960 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 293 | 0.2 M NaCl, 0.1 M Bis-Tris, 25% PEG3350 |