8P2A
Crystal structure of SaFMN3 domain 2
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | ESRF BEAMLINE MASSIF-1 |
Synchrotron site | ESRF |
Beamline | MASSIF-1 |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2022-04-22 |
Detector | DECTRIS PILATUS3 6M |
Wavelength(s) | 0.9655 |
Spacegroup name | P 65 2 2 |
Unit cell lengths | 25.954, 25.954, 364.838 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 30.420 - 2.000 |
R-factor | 0.23395 |
Rwork | 0.231 |
R-free | 0.29763 |
Structure solution method | MOLECULAR REPLACEMENT |
RMSD bond length | 0.008 |
RMSD bond angle | 1.510 |
Data reduction software | XDS |
Data scaling software | Aimless |
Phasing software | PHASER |
Refinement software | REFMAC (5.8.0350) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 45.600 | 2.050 |
High resolution limit [Å] | 2.000 | 2.000 |
Rmerge | 0.140 | 0.452 |
Rmeas | 0.146 | 0.473 |
Rpim | 0.039 | 0.137 |
Total number of observations | 78876 | 4505 |
Number of reflections | 5999 | 408 |
<I/σ(I)> | 9 | 2.4 |
Completeness [%] | 100.0 | |
Redundancy | 13.1 | 11 |
CC(1/2) | 0.996 | 0.982 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 294 | 38 - 42 % PEG3350, 0.05 M bis-tris |