2Y6Z
Crystallographic structure of GM23 an example of Catalytic migration from TIM to thiamin phosphate synthase.
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | NSLS BEAMLINE X6A |
Synchrotron site | NSLS |
Beamline | X6A |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2006-01-25 |
Detector | ADSC QUANTUM 210 |
Spacegroup name | P 65 2 2 |
Unit cell lengths | 126.300, 126.300, 107.290 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 33.992 - 2.600 |
R-factor | 0.1912 |
Rwork | 0.194 |
R-free | 0.23500 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 1tri |
RMSD bond length | 0.012 |
RMSD bond angle | 1.196 |
Data reduction software | XDS |
Data scaling software | SCALA |
Phasing software | PHASER |
Refinement software | PHENIX ((PHENIX.REFINE)) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 34.000 | 2.760 |
High resolution limit [Å] | 2.600 | 2.600 |
Rmerge | 0.060 | 0.500 |
Number of reflections | 15823 | |
<I/σ(I)> | 19.6 | 2.8 |
Completeness [%] | 99.0 | 98.7 |
Redundancy | 4.7 | 4.5 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | 6.5 | PROTEIN WAS CRYSTALLIZED FROM 2 M LI2SO4, 100 MM MES, PH 6.5 |