6PTY
Soluble model of human CuA (Tt3Lh)
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | ESRF BEAMLINE ID23-1 |
| Synchrotron site | ESRF |
| Beamline | ID23-1 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2017-07-13 |
| Detector | DECTRIS PILATUS 6M |
| Wavelength(s) | 1.3679 |
| Spacegroup name | P 21 21 21 |
| Unit cell lengths | 51.630, 70.957, 77.415 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 42.950 - 1.980 |
| R-factor | 0.2002 |
| Rwork | 0.198 |
| R-free | 0.23830 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 2cua |
| RMSD bond length | 0.004 |
| RMSD bond angle | 0.680 |
| Data reduction software | XDS |
| Data scaling software | Aimless |
| Phasing software | PHASER |
| Refinement software | PHENIX (1.14rc3_3199) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 42.950 | 2.030 |
| High resolution limit [Å] | 1.980 | 1.980 |
| Rmerge | 0.058 | 0.309 |
| Rmeas | 0.065 | 0.349 |
| Rpim | 0.028 | 0.158 |
| Number of reflections | 20219 | 1363 |
| <I/σ(I)> | 17.5 | 3 |
| Completeness [%] | 99.1 | 98.5 |
| Redundancy | 5 | 4.8 |
| CC(1/2) | 0.998 | 0.981 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION | 291 | 100 mM Hepes, 1.6 M (NH4)2SO4, 0.1 mM NaCl, pH 7.5 |
