5KGL
2.45A resolution structure of Apo independent phosphoglycerate mutase from C. elegans (orthorhombic form)
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | APS BEAMLINE 17-ID |
Synchrotron site | APS |
Beamline | 17-ID |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2014-04-19 |
Detector | DECTRIS PILATUS 6M |
Wavelength(s) | 1.00000 |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 70.321, 98.852, 173.144 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 40.437 - 2.450 |
R-factor | 0.1883 |
Rwork | 0.185 |
R-free | 0.25950 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 2ify |
RMSD bond length | 0.009 |
RMSD bond angle | 0.936 |
Data reduction software | XDS |
Data scaling software | Aimless (0.2.17) |
Phasing software | PHASER (2.5.7) |
Refinement software | PHENIX |
Data quality characteristics
Overall | Inner shell | Outer shell | |
Low resolution limit [Å] | 98.850 | 98.850 | 2.540 |
High resolution limit [Å] | 2.450 | 9.170 | 2.450 |
Rmerge | 0.205 | 0.051 | 0.840 |
Rmeas | 0.229 | ||
Rpim | 0.099 | ||
Total number of observations | 217179 | ||
Number of reflections | 43707 | ||
<I/σ(I)> | 7.6 | ||
Completeness [%] | 97.5 | 90.8 | 99.4 |
Redundancy | 5 | 5.2 | 4.7 |
CC(1/2) | 0.976 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 6.5 | 293 | 25% (w/v) PEG 3350, 0.1 M Bis-Tris, 0.2 M ammonium sulfate |