5Y0M
Structure of 6-aminohexanoate-oligomer hydrolase from Arthrobacter sp. KI72., D36A/D122G/H130Y/E263Q mutant
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SPRING-8 BEAMLINE BL44XU |
Synchrotron site | SPring-8 |
Beamline | BL44XU |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2013-06-13 |
Detector | RAYONIX MX300HE |
Wavelength(s) | 0.9000 |
Spacegroup name | C 2 2 21 |
Unit cell lengths | 70.418, 144.424, 128.268 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 72.210 - 1.030 |
R-factor | 0.11693 |
Rwork | 0.116 |
R-free | 0.13442 |
Structure solution method | MOLECULAR REPLACEMENT |
RMSD bond length | 0.019 |
RMSD bond angle | 1.980 |
Data reduction software | HKL-2000 |
Data scaling software | HKL-2000 |
Phasing software | PHASER |
Refinement software | REFMAC (5.5.0109) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 100.000 | 1.040 |
High resolution limit [Å] | 1.030 | 1.030 |
Rmerge | 0.070 | 0.941 |
Number of reflections | 318913 | 12557 |
<I/σ(I)> | 41.9 | 2.39 |
Completeness [%] | 99.9 | 99.3 |
Redundancy | 9.7 | 6.8 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 293 | 1.2-2.2 M ammonium sulphate, 0.2 M NaCl, 0.1 M HEPES buffer pH 7.5-8.5 |