2GG0
Novel bacterial methionine aminopeptidase inhibitors
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 | 2002-01-01 |
Detector | ADSC QUANTUM 4 |
Wavelength(s) | 1.0 |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 39.481, 63.055, 52.641 |
Unit cell angles | 90.00, 109.88, 90.00 |
Refinement procedure
Resolution | 24.750 - 1.280 |
R-factor | 0.163 |
Rwork | 0.163 |
R-free | 0.20900 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 1c27 |
RMSD bond length | 0.009 |
RMSD bond angle | 1.499 |
Data scaling software | SCALEPACK |
Phasing software | AMoRE |
Refinement software | REFMAC |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 24.750 | 1.400 |
High resolution limit [Å] | 1.280 | 1.280 |
Rmerge | 0.033 | 0.176 |
Number of reflections | 57560 | |
<I/σ(I)> | 17.2 | 6.3 |
Completeness [%] | 93.0 | 79.3 |
Redundancy | 2 | 1.1 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | batch | 7 | 298 | 10 mg/ml protein, 25% PEG 8000, 100 mM TRIS-HCl, 1-5 mM inhibitor, pH 7.0, batch, temperature 298K |