7T5E
Neutron structure of Neurospora crassa Polysaccharide Monooxygenase 9D (NcLPMO9D) low pH vapor exchange
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | ROTATING ANODE |
Source details | RIGAKU MICROMAX-007 |
Temperature [K] | 295 |
Detector technology | PIXEL |
Collection date | 2018-10-25 |
Detector | DECTRIS EIGER R 4M |
Wavelength(s) | 1.54 |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 68.296, 42.269, 70.413 |
Unit cell angles | 90.00, 98.47, 90.00 |
Refinement procedure
Resolution | 14.649 - 2.144 |
R-factor | 0.148 |
Rwork | 0.144 |
R-free | 0.21370 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 5tkh |
RMSD bond length | 0.010 |
RMSD bond angle | 1.322 |
Data reduction software | CrysalisPro |
Data scaling software | Aimless |
Phasing software | PHASER |
Refinement software | PHENIX (1.14_3260) |
Data quality characteristics
Overall | Inner shell | Outer shell | |
Low resolution limit [Å] | 12.650 | 2.220 | 1.900 |
High resolution limit [Å] | 1.900 | 2.140 | 1.900 |
Rmerge | 0.115 | 0.328 | 0.299 |
Rmeas | 0.126 | 0.382 | 0.344 |
Number of reflections | 30950 | 1655 | 2859 |
<I/σ(I)> | 15.24 | 3.02 | 4.4 |
Completeness [%] | 97.6 | 74.75 | 91.75 |
Redundancy | 6.1 | 3.3 | 4.1 |
CC(1/2) | 0.991 | 0.363 | 0.880 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION | 4.4 | 295 | PEG 3350, HEPES |
1 | VAPOR DIFFUSION | 4.4 | 295 | PEG 3350, HEPES |