6AIM
Cab2 mutant H337A complex with phosphopantothenate-cysteine
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SSRF BEAMLINE BL18U1 |
| Synchrotron site | SSRF |
| Beamline | BL18U1 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2017-12-25 |
| Detector | DECTRIS PILATUS3 6M |
| Wavelength(s) | 0.97852 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 51.695, 113.561, 55.786 |
| Unit cell angles | 90.00, 91.31, 90.00 |
Refinement procedure
| Resolution | 56.780 - 2.040 |
| R-factor | 0.1792 |
| Rwork | 0.177 |
| R-free | 0.21480 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 1p9o |
| RMSD bond length | 0.007 |
| RMSD bond angle | 1.229 |
| 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] | 56.780 | 2.090 |
| High resolution limit [Å] | 2.040 | 2.040 |
| Rmerge | 0.091 | 0.596 |
| Rmeas | 0.099 | 0.656 |
| Rpim | 0.039 | 0.269 |
| Number of reflections | 40365 | 2015 |
| <I/σ(I)> | 18.13 | |
| Completeness [%] | 99.8 | 99.5 |
| Redundancy | 6.4 | 5.6 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 287 | 200mM ammonium tartrate, 20% PEG 3350,2mM DTT, 2mM MnCl2 |
