8GKQ
Crystal Structure Analysis of Aspergillus fumigatus alkaline protease
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SSRL BEAMLINE BL12-2 |
Synchrotron site | SSRL |
Beamline | BL12-2 |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2021-10-17 |
Detector | DECTRIS PILATUS 6M |
Wavelength(s) | 0.97946 |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 59.255, 66.074, 86.794 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 30.570 - 1.650 |
R-factor | 0.2086 |
Rwork | 0.207 |
R-free | 0.24680 |
Structure solution method | MOLECULAR REPLACEMENT |
RMSD bond length | 0.012 |
RMSD bond angle | 1.467 |
Data reduction software | XDS |
Data scaling software | SCALA (3.3.22) |
Phasing software | PHASER |
Refinement software | REFMAC (5.8.0135) |
Data quality characteristics
Overall | Inner shell | Outer shell | |
Low resolution limit [Å] | 52.573 | 36.273 | 1.740 |
High resolution limit [Å] | 1.650 | 5.220 | 1.650 |
Rmerge | 0.031 | 1.068 | |
Rmeas | 0.093 | 0.037 | 1.307 |
Rpim | 0.052 | 0.020 | 0.741 |
Total number of observations | 122123 | 4082 | 17935 |
Number of reflections | 40727 | 1318 | 5985 |
<I/σ(I)> | 6.8 | 20.4 | 1 |
Completeness [%] | 98.1 | 91.8 | 99.7 |
Redundancy | 3 | 3.1 | 3 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | EVAPORATION | 289 | PEG 1000, PEG 3350, MPD, MOPS/HEPES |