3F4B
Crystal structure of Plasmodium berghei Enoyl-acyl-carrier-protein reductase with TRICLOSAN
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | APS BEAMLINE 19-ID |
Synchrotron site | APS |
Beamline | 19-ID |
Temperature [K] | 120 |
Detector technology | CCD |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 64.339, 121.200, 87.832 |
Unit cell angles | 90.00, 108.97, 90.00 |
Refinement procedure
Resolution | 36.330 - 2.490 |
R-factor | 0.1835 |
Rwork | 0.183 |
R-free | 0.25400 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 1nhg |
Data reduction software | HKL-2000 |
Data scaling software | HKL-2000 |
Phasing software | AMoRE |
Refinement software | PHENIX |
Data quality characteristics
Overall | |
Low resolution limit [Å] | 36.330 |
High resolution limit [Å] | 2.490 |
Number of reflections | 41328 |
Completeness [%] | 95.0 |
Redundancy | 3.6 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 7.1 | 289 | 100mM Tris pH 7.1, 14% PEG2000, 100mM NaCl, VAPOR DIFFUSION, HANGING DROP, temperature 289K |