6AI9
Cab2 mutant-H337A complex with phosphopantothenate
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | ROTATING ANODE |
Source details | RIGAKU MICROMAX-007 |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2017-09-15 |
Detector | DECTRIS PILATUS3 R 200K-A |
Wavelength(s) | 1.5418 |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 51.704, 113.517, 55.777 |
Unit cell angles | 90.00, 91.12, 90.00 |
Refinement procedure
Resolution | 56.760 - 2.090 |
R-factor | 0.2059 |
Rwork | 0.203 |
R-free | 0.24820 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 1p9o |
RMSD bond length | 0.007 |
RMSD bond angle | 1.234 |
Data reduction software | HKL-2000 |
Data scaling software | HKL-2000 |
Phasing software | MOLREP |
Refinement software | REFMAC (5.8.0155) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 56.760 | 2.140 |
High resolution limit [Å] | 2.090 | 2.090 |
Rmerge | 0.087 | 0.383 |
Rmeas | 0.104 | |
Rpim | 0.056 | 0.056 |
Number of reflections | 36076 | 1819 |
<I/σ(I)> | 11.41 | 2.56 |
Completeness [%] | 97.2 | 96.8 |
Redundancy | 3 | 2.3 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 287 | 200mM ammonium tartrate, 20% PEG 3350 |