3UE1
Crystal strucuture of Acinetobacter baumanni PBP1A in complex with MC-1
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | APS BEAMLINE 17-ID |
Synchrotron site | APS |
Beamline | 17-ID |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2010-12-20 |
Detector | ADSC QUANTUM 315 |
Wavelength(s) | 1 |
Spacegroup name | P 21 21 2 |
Unit cell lengths | 119.210, 244.290, 49.470 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 39.570 - 2.730 |
R-factor | 0.1744 |
Rwork | 0.172 |
R-free | 0.21920 |
Structure solution method | FOURIER SYNTHESIS |
RMSD bond length | 0.010 |
RMSD bond angle | 1.170 |
Data scaling software | autoPROC |
Phasing software | PHASER |
Refinement software | BUSTER (2.9.6) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 244.000 | 2.742 |
High resolution limit [Å] | 2.700 | 2.700 |
Number of reflections | 39354 | |
Completeness [%] | 93.2 | 75.3 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 6.5 | 298 | 25% PEGmme 5000, 0.1M MES pH 6.5, 0.1M sodium acetate, VAPOR DIFFUSION, HANGING DROP, temperature 298K |