5AJH
Crystal structure of Fusarium oxysporum cutinase
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 | CCD |
Collection date | 2014-07-17 |
Detector | MARMOSAIC 225 mm CCD |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 35.906, 60.141, 241.965 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 120.980 - 1.900 |
R-factor | 0.18355 |
Rwork | 0.181 |
R-free | 0.22373 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 1cex |
RMSD bond length | 0.008 |
RMSD bond angle | 1.212 |
Data reduction software | XDS |
Data scaling software | Aimless |
Phasing software | PHASER |
Refinement software | REFMAC (5.8.0073) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 120.900 | 1.940 |
High resolution limit [Å] | 1.900 | 1.900 |
Rmerge | 0.230 | 1.270 |
Number of reflections | 42540 | |
<I/σ(I)> | 7.5 | 1.5 |
Completeness [%] | 99.8 | 100 |
Redundancy | 8.6 | 8.5 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | 8.5 | 0.12M MONOSACCHARIDES, PH 8.5 12.5% MPD, 12.5% PEG1000, 12.5% PEG3350 |