6A8I
Crystal structure of endo-arabinanase ABN-TS D147N mutant in complex with arabinohexaose
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | PHOTON FACTORY BEAMLINE BL-6A |
Synchrotron site | Photon Factory |
Beamline | BL-6A |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2008-11-17 |
Detector | ADSC QUANTUM 4 |
Wavelength(s) | 0.978 |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 45.809, 92.260, 78.673 |
Unit cell angles | 90.00, 91.52, 90.00 |
Refinement procedure
Resolution | 50.000 - 1.900 |
R-factor | 0.18358 |
Rwork | 0.181 |
R-free | 0.23286 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 1wl7 |
RMSD bond length | 0.020 |
RMSD bond angle | 1.977 |
Data reduction software | HKL-2000 |
Data scaling software | HKL-2000 |
Phasing software | MOLREP |
Refinement software | REFMAC (5.8.0049) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 50.000 | 1.930 |
High resolution limit [Å] | 1.900 | 1.900 |
Rpim | 0.055 | 0.324 |
Number of reflections | 51538 | 2522 |
<I/σ(I)> | 13.9 | |
Completeness [%] | 99.2 | 97.6 |
Redundancy | 3.7 | 3.6 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 5.5 | 293 | 16% PEG 8000, 0.2M magnesium chloride, 0.1M MES pH 5.5 |