2Y3I
The structure of the fully closed conformation of human PGK in complex with L-ADP, 3PG and the TSA aluminium tetrafluoride
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | ESRF BEAMLINE ID23-2 |
Synchrotron site | ESRF |
Beamline | ID23-2 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2010-09-03 |
Detector | MARRESEARCH |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 38.419, 103.877, 203.094 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 20.000 - 2.900 |
R-factor | 0.2647 |
Rwork | 0.263 |
R-free | 0.30322 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 2wzc |
RMSD bond length | 0.017 |
RMSD bond angle | 1.683 |
Data reduction software | XDS |
Data scaling software | SCALA |
Phasing software | MOLREP |
Refinement software | REFMAC (5.6.0085) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 46.240 | 3.060 |
High resolution limit [Å] | 2.900 | 2.900 |
Rmerge | 0.130 | 0.510 |
Number of reflections | 17028 | |
<I/σ(I)> | 7.7 | 2.3 |
Completeness [%] | 90.7 | 99.1 |
Redundancy | 3 | 3.1 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | 6.5 | 26% PEG 2000MME, 0.1 M BIS/TRIS PH 6.5 . |