5CLS
Structure of human methionine aminopeptidase-2 complexed with spiroepoxytriazole inhibitor (+)-31a
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | ESRF BEAMLINE ID23-2 |
Synchrotron site | ESRF |
Beamline | ID23-2 |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2013-07-30 |
Detector | DECTRIS PILATUS 6M |
Wavelength(s) | 0.87260 |
Spacegroup name | C 2 2 21 |
Unit cell lengths | 89.620, 101.180, 100.280 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 55.820 - 1.750 |
R-factor | 0.16095 |
Rwork | 0.160 |
R-free | 0.18885 |
Structure solution method | MOLECULAR REPLACEMENT |
RMSD bond length | 0.019 |
RMSD bond angle | 2.018 |
Data reduction software | XDS |
Data scaling software | XSCALE |
Phasing software | PHASER |
Refinement software | REFMAC (5.7.0032) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 56.000 | 1.795 |
High resolution limit [Å] | 1.750 | 1.750 |
Rmerge | 0.053 | 0.758 |
Number of reflections | 45986 | |
<I/σ(I)> | 16.2 | 2 |
Completeness [%] | 99.5 | 99.6 |
Redundancy | 3.58 | 3.1 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 5.4 | 292 | Na Citrate, Tert-butanol |