4EAD
Thymidine phosphorylase from E.coli with 3'-azido-2'-fluoro-dideoxyuridine
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SPRING-8 BEAMLINE BL41XU |
Synchrotron site | SPring-8 |
Beamline | BL41XU |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2011-10-09 |
Detector | RAYONIX MX225HE |
Spacegroup name | P 43 21 2 |
Unit cell lengths | 129.862, 129.862, 67.656 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 16.000 - 1.500 |
R-factor | 0.147 |
Rwork | 0.145 |
R-free | 0.19200 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 2tpt |
RMSD bond length | 0.008 |
RMSD bond angle | 1.443 |
Data reduction software | HKL-2000 |
Data scaling software | HKL-2000 |
Phasing software | PHASER |
Refinement software | REFMAC (5.6.0117) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 30.000 | 1.510 |
High resolution limit [Å] | 1.500 | 1.500 |
Rmerge | 0.062 | 0.519 |
Number of reflections | 92521 | |
<I/σ(I)> | 3.24 | |
Completeness [%] | 99.8 | 99.7 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | 273 | COUNTER DIFFUSION, LIQUID DIFFUSION, temperature 273K |