4YI5
Crystal structure of Gpb in complex with 4b
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | MAX II BEAMLINE I911-2 |
Synchrotron site | MAX II |
Beamline | I911-2 |
Temperature [K] | 293 |
Detector technology | CCD |
Collection date | 2014-12-04 |
Detector | MAR CCD 165 mm |
Wavelength(s) | 1.0403 |
Spacegroup name | P 43 21 2 |
Unit cell lengths | 128.540, 128.540, 116.630 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 38.880 - 1.800 |
R-factor | 0.1957 |
Rwork | 0.194 |
R-free | 0.23042 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 4mho |
RMSD bond length | 0.009 |
RMSD bond angle | 1.367 |
Data reduction software | MOSFLM |
Data scaling software | SCALA |
Refinement software | REFMAC (5.7.0032) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 38.880 | 1.850 |
High resolution limit [Å] | 1.800 | 1.800 |
Number of reflections | 12263 | |
<I/σ(I)> | 5.5 | 1.8 |
Completeness [%] | 91.5 | 94.6 |
Redundancy | 2.8 | 2.7 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | SMALL TUBES | 6.8 | 289 | 10mM BES buffer |