8W08
Crystal Structure of the worst case reconstruction of the ancestral triosephosphate isomerase of the last opisthokont common ancestor obtained by maximum likelihood
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | ROTATING ANODE |
Source details | RIGAKU MICROMAX-007 HF |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2019-02-04 |
Detector | DECTRIS PILATUS3 R 200K-A |
Wavelength(s) | 1.54178 |
Spacegroup name | P 2 21 21 |
Unit cell lengths | 42.461, 106.831, 114.792 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 32.520 - 1.880 |
R-factor | 0.1942 |
Rwork | 0.193 |
R-free | 0.22510 |
Structure solution method | MOLECULAR REPLACEMENT |
RMSD bond length | 0.008 |
RMSD bond angle | 0.934 |
Data reduction software | XDS |
Data scaling software | Aimless |
Phasing software | PHASES |
Refinement software | PHENIX ((1.20.1_4487: ???)) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 32.520 | 1.920 |
High resolution limit [Å] | 1.880 | 1.880 |
Number of reflections | 43361 | 2757 |
<I/σ(I)> | 20.7 | 2 |
Completeness [%] | 99.9 | |
Redundancy | 13 | 9.5 |
CC(1/2) | 0.999 | 0.875 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 291 | 0.2 M ammonium fluoride, 20 % w/v PEG 3350 |