4Z7M
Novel Inhibitors of Bacterial Methionine Aminopeptidase with Broad-Spectrum Biochemical Activity
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | APS BEAMLINE 23-ID-B |
Synchrotron site | APS |
Beamline | 23-ID-B |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2014-06-27 |
Detector | MARMOSAIC 300 mm CCD |
Wavelength(s) | 1.000 |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 61.985, 62.712, 72.978 |
Unit cell angles | 90.00, 89.59, 90.00 |
Refinement procedure
Resolution | 47.570 - 1.430 |
R-factor | 0.2539 |
Rwork | 0.251 |
R-free | 0.30550 |
Structure solution method | MOLECULAR REPLACEMENT |
RMSD bond length | 0.017 |
RMSD bond angle | 1.863 |
Data reduction software | d*TREK |
Data scaling software | SCALA |
Phasing software | AMoRE |
Refinement software | REFMAC (5.8.0103) |
Data quality characteristics
Overall | |
Low resolution limit [Å] | 47.570 |
High resolution limit [Å] | 1.430 |
Number of reflections | 71302 |
<I/σ(I)> | 4.3 |
Completeness [%] | 92.1 |
Redundancy | 6 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 5.8 | 100 mM MES, 1.1 M ammonium sulfate, 0.1 M potassium chloride, 9% trehalose |