8BZQ
Beta-1,4-D-endoglucanase Cel45A from Gloeophyllum trabeum
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | ESRF BEAMLINE ID30B |
Synchrotron site | ESRF |
Beamline | ID30B |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2021-06-30 |
Detector | DECTRIS PILATUS3 6M |
Wavelength(s) | 0.976254 |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 28.970, 48.410, 45.790 |
Unit cell angles | 90.00, 92.21, 90.00 |
Refinement procedure
Resolution | 45.760 - 1.300 |
R-factor | 0.1663 |
Rwork | 0.166 |
R-free | 0.18260 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 5kjo |
RMSD bond length | 0.005 |
RMSD bond angle | 0.926 |
Data reduction software | XDS |
Data scaling software | XSCALE |
Phasing software | PHENIX (1.19.2_4158) |
Refinement software | PHENIX (1.19.2_4158) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 45.760 | 1.346 |
High resolution limit [Å] | 1.300 | 1.300 |
Rmeas | 0.180 | 0.187 |
Number of reflections | 31123 | 3078 |
<I/σ(I)> | 8.9 | 9.51 |
Completeness [%] | 99.7 | 99.26 |
Redundancy | 12.84 | 6.9 |
CC(1/2) | 0.980 | 0.970 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 7.5 | 298 | 0.1M HEPES 7.5, 20% PEG 3350, 3mM NiCl2, protein 14 mg/mL |