6QEJ
CRYSTAL STRUCTURE OF HUMAN METHIONINE AMINOPEPTIDASE-2 IN COMPLEX WITH AN INHIBITOR Thiophene-2-sulfonic acid (4-fluoro-benzyl)-(4H-[1,2,4]triazol-3-ylmethyl)-amide
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SLS BEAMLINE X06DA |
Synchrotron site | SLS |
Beamline | X06DA |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2006-02-09 |
Detector | MAR CCD 130 mm |
Wavelength(s) | 1.000000 |
Spacegroup name | C 2 2 21 |
Unit cell lengths | 90.565, 99.929, 100.941 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 24.250 - 1.620 |
R-factor | 0.167 |
Rwork | 0.167 |
R-free | 0.18400 |
RMSD bond length | 0.010 |
RMSD bond angle | 1.050 |
Data reduction software | DENZO |
Data scaling software | SCALEPACK |
Phasing software | MOLREP |
Refinement software | BUSTER (2.11.7) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 24.260 | 1.690 |
High resolution limit [Å] | 1.620 | 1.620 |
Rmerge | 0.053 | 0.224 |
Number of reflections | 56275 | 5301 |
<I/σ(I)> | 16.7 | 3.5 |
Completeness [%] | 95.5 | 72.9 |
Redundancy | 3.3 | 2.1 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 6 | 277 | 20% METHANOL, 0.1 M CITRATE, PH 6.0, |