6HDL
R49K variant of beta-phosphoglucomutase from Lactococcus lactis complexed with magnesium trifluoride and beta-G6P to 1.2 A.
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | DIAMOND BEAMLINE I03 |
| Synchrotron site | Diamond |
| Beamline | I03 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2016-12-18 |
| Detector | DECTRIS PILATUS3 6M |
| Wavelength(s) | 0.97629 |
| Spacegroup name | P 21 21 21 |
| Unit cell lengths | 37.550, 54.300, 104.200 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 35.350 - 1.160 |
| R-factor | 0.13387 |
| Rwork | 0.132 |
| R-free | 0.16356 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 2wf5 |
| RMSD bond length | 0.011 |
| RMSD bond angle | 1.506 |
| Data reduction software | xia2 |
| Data scaling software | xia2 |
| Phasing software | MOLREP |
| Refinement software | REFMAC (5.8.0230) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 37.550 | 1.180 |
| High resolution limit [Å] | 1.160 | 1.160 |
| Rmerge | 0.068 | 1.345 |
| Rmeas | 0.073 | 1.475 |
| Rpim | 0.027 | 0.591 |
| Number of reflections | 73452 | 3389 |
| <I/σ(I)> | 14.2 | |
| Completeness [%] | 98.5 | 92.3 |
| Redundancy | 7.1 | 5.9 |
| CC(1/2) | 0.999 | 0.515 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 7.2 | 291 | 24-34% PEG 4000 200mM sodium acetate 50mM TRIS pH 7.5 |
