3LUN
Structure of ulilysin mutant M290C
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | ESRF BEAMLINE ID23-1 |
Synchrotron site | ESRF |
Beamline | ID23-1 |
Detector technology | CCD |
Collection date | 2009-04-03 |
Detector | ADSC QUANTUM 315r |
Spacegroup name | C 2 2 21 |
Unit cell lengths | 58.510, 116.290, 164.760 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 39.930 - 1.800 |
R-factor | 0.16128 |
Rwork | 0.161 |
R-free | 0.20810 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 2cki |
RMSD bond length | 0.016 |
RMSD bond angle | 1.650 |
Data scaling software | SCALA |
Phasing software | AMoRE |
Refinement software | REFMAC (5.5.0102) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 47.500 | 1.900 |
High resolution limit [Å] | 1.800 | 1.800 |
Rmerge | 0.050 | 0.171 |
Number of reflections | 52160 | |
<I/σ(I)> | 28.5 | 10.9 |
Redundancy | 8.1 | 6.8 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 7 | pH 7, VAPOR DIFFUSION, SITTING DROP |