2XE6
The complete reaction cycle of human phosphoglycerate kinase: The open binary complex with 3PG
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | ESRF BEAMLINE ID14-2 |
| Synchrotron site | ESRF |
| Beamline | ID14-2 |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2009-06-26 |
| Detector | ADSC CCD |
| Spacegroup name | P 21 21 2 |
| Unit cell lengths | 61.570, 73.010, 93.640 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 20.000 - 1.740 |
| R-factor | 0.20807 |
| Rwork | 0.206 |
| R-free | 0.25250 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 3c39 |
| RMSD bond length | 0.023 |
| RMSD bond angle | 1.856 |
| Data reduction software | MOSFLM |
| Data scaling software | SCALA |
| Phasing software | MOLREP |
| Refinement software | REFMAC (5.5.0102) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 20.000 | 1.830 |
| High resolution limit [Å] | 1.740 | 1.740 |
| Rmerge | 0.100 | 0.290 |
| Number of reflections | 43561 | |
| <I/σ(I)> | 8.1 | 3.2 |
| Completeness [%] | 98.9 | 100 |
| Redundancy | 4.1 | 3.7 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | 8 | 30% PEG4000, 100MM TRIS PH 8.0 |
