6I5X
Crystal structure of Aspergillus fumigatus phosphomannomutase
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | ROTATING ANODE |
Source details | RIGAKU MICROMAX-007 HF |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2017-02-21 |
Detector | RIGAKU SATURN 944 |
Wavelength(s) | 1.54178 |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 80.425, 102.024, 137.791 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 46.600 - 2.200 |
R-factor | 0.20056 |
Rwork | 0.198 |
R-free | 0.24448 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 2fue |
Data reduction software | XDS |
Data scaling software | Aimless |
Phasing software | MOLREP |
Refinement software | REFMAC (5.8.0232) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 46.600 | 2.279 |
High resolution limit [Å] | 2.200 | 2.200 |
Rmerge | 0.149 | |
Rmeas | 0.173 | |
Rpim | 0.086 | |
Number of reflections | 56365 | |
<I/σ(I)> | 5.7 | |
Completeness [%] | 98.0 | |
Redundancy | 3.6 | |
CC(1/2) | 0.989 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 277 | 0.09 M NPS, 0.1 M MES/Imidazole pH 6.5, 20% v/v PEG500 MME, 10% w/v PEG 20000 |