1Q1K
Structure of ATP-phosphoribosyltransferase from E. coli complexed with PR-ATP
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SRS BEAMLINE PX9.6 |
Synchrotron site | SRS |
Beamline | PX9.6 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2002-07-05 |
Detector | ADSC QUANTUM 4 |
Wavelength(s) | 0.86 |
Spacegroup name | H 3 2 |
Unit cell lengths | 132.100, 132.100, 113.379 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 50.000 - 2.900 |
R-factor | 0.21454 |
Rwork | 0.210 |
R-free | 0.27243 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 1h3d |
RMSD bond length | 0.018 |
RMSD bond angle | 2.018 |
Data reduction software | DENZO |
Data scaling software | SCALEPACK |
Phasing software | AMoRE |
Refinement software | REFMAC (5.1.24) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 50.000 | 3.020 |
High resolution limit [Å] | 2.900 | 2.900 |
Rmerge | 0.058 | 0.581 |
Number of reflections | 8521 | |
<I/σ(I)> | 16.9 | 2 |
Completeness [%] | 99.3 | 99.9 |
Redundancy | 4.2 | 4.2 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 5.6 | 298 | sodium tartrate, magnesium chloride, sodium citrate, pH 5.6, VAPOR DIFFUSION, SITTING DROP, temperature 298K |