3C3A
Crystal Structure of human phosphoglycerate kinase bound to 3-phosphoglycerate and L-ADP
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | ESRF BEAMLINE ID29 |
Synchrotron site | ESRF |
Beamline | ID29 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2006-09-18 |
Detector | ADSC QUANTUM 315 |
Wavelength(s) | 0.934 |
Spacegroup name | P 1 |
Unit cell lengths | 35.629, 55.949, 95.441 |
Unit cell angles | 101.88, 95.20, 82.91 |
Refinement procedure
Resolution | 43.200 - 2.300 |
R-factor | 0.18084 |
Rwork | 0.179 |
R-free | 0.27789 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 1vjc |
RMSD bond length | 0.014 |
RMSD bond angle | 1.630 |
Data reduction software | MOSFLM |
Data scaling software | SCALA |
Phasing software | MOLREP |
Refinement software | REFMAC (5.4.0062) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 51.640 | 2.420 |
High resolution limit [Å] | 2.300 | 2.300 |
Rmerge | 0.081 | 0.318 |
Number of reflections | 26390 | |
<I/σ(I)> | 9.3 | 2.7 |
Completeness [%] | 84.9 | 55.3 |
Redundancy | 2.1 | 2.1 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 8.3 | 291 | 2.6M NaKPO4, pH 8.3, VAPOR DIFFUSION, HANGING DROP, temperature 291K |