2C0H
X-ray structure of beta-mannanase from blue mussel Mytilus edulis
Experimental procedure
Experimental method | MAD |
Source type | SYNCHROTRON |
Source details | ESRF BEAMLINE ID14-1 |
Synchrotron site | ESRF |
Beamline | ID14-1 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2001-10-01 |
Detector | MARRESEARCH |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 62.073, 65.164, 93.086 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 19.730 - 1.600 |
R-factor | 0.191 |
Rwork | 0.190 |
R-free | 0.21000 |
Structure solution method | MAD |
RMSD bond length | 0.010 |
RMSD bond angle | 1.300 |
Data reduction software | MOSFLM |
Data scaling software | SCALA |
Phasing software | SHELXD |
Refinement software | REFMAC (5.2.0005) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 52.700 | 1.690 |
High resolution limit [Å] | 1.600 | 1.600 |
Rmerge | 0.170 | 0.310 |
Number of reflections | 48523 | |
<I/σ(I)> | 11.6 | 4.9 |
Completeness [%] | 98.5 | 98.1 |
Redundancy | 5.4 | 4.8 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | 6.5 | 0.1 M MES PH6.5, 0.2 M AMMONIUM SULPHATE, 25%(W/V) MME PEG 5000, 3% DIOXANE, pH 6.50 |