4YI3
Crystal structure of Gpb in complex with 4a
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 | 2014-12-03 |
Detector | MAR CCD 165 mm |
Wavelength(s) | 1.0403 |
Spacegroup name | P 43 21 2 |
Unit cell lengths | 128.460, 128.460, 116.580 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 38.360 - 1.800 |
R-factor | 0.17546 |
Rwork | 0.174 |
R-free | 0.19762 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 4mho |
RMSD bond length | 0.009 |
RMSD bond angle | 1.291 |
Data reduction software | DENZO |
Data scaling software | SCALA |
Refinement software | REFMAC (5.7.0032) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 38.360 | 1.850 |
High resolution limit [Å] | 1.800 | 1.800 |
Number of reflections | 6609 | |
<I/σ(I)> | 11.6 | 4.2 |
Completeness [%] | 99.7 | 99.9 |
Redundancy | 4.6 | 4.5 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | SMALL TUBES | 6.8 | 289 | 10mM BES buffer |