7DVJ
Structure of beta-mannanase BaMan113A with mannobiose
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SSRF BEAMLINE BL19U1 |
Synchrotron site | SSRF |
Beamline | BL19U1 |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2018-10-19 |
Detector | DECTRIS PILATUS3 S 6M |
Wavelength(s) | 0.979 |
Spacegroup name | P 2 21 21 |
Unit cell lengths | 56.493, 110.284, 150.438 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 25.000 - 1.650 |
R-factor | 0.1665 |
Rwork | 0.165 |
R-free | 0.18820 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 3civ |
RMSD bond length | 0.011 |
RMSD bond angle | 1.585 |
Data reduction software | HKL-2000 |
Data scaling software | HKL-2000 |
Phasing software | PHASER |
Refinement software | REFMAC (5.8.0257) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 25.000 | 1.710 |
High resolution limit [Å] | 1.650 | 1.650 |
Number of reflections | 108815 | 10962 |
<I/σ(I)> | 11.8 | |
Completeness [%] | 97.9 | |
Redundancy | 7.4 | |
CC(1/2) | 0.858 | 0.905 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 295 | tacsimate pH 7.0 |