3NT0
C500S (T1D) Mutant of CueO soaked in and bound to Cu(I)
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | APS BEAMLINE 14-BM-C |
| Synchrotron site | APS |
| Beamline | 14-BM-C |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2004-04-01 |
| Detector | ADSC QUANTUM 315 |
| Wavelength(s) | .9002 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 50.861, 92.507, 54.330 |
| Unit cell angles | 90.00, 102.47, 90.00 |
Refinement procedure
| Resolution | 20.500 - 1.800 |
| R-factor | 0.20937 |
| Rwork | 0.207 |
| R-free | 0.26082 |
| Structure solution method | UNnecessary |
| Starting model (for MR) | 1kv7 |
| RMSD bond length | 0.014 |
| RMSD bond angle | 1.466 |
| Data reduction software | CrystalClear |
| Data scaling software | CrystalClear |
| Refinement software | REFMAC (5.5.0109) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 20.500 | 1.860 |
| High resolution limit [Å] | 1.800 | 1.800 |
| Rmerge | 0.150 | 0.330 |
| Number of reflections | 42528 | |
| <I/σ(I)> | 8.4 | 2.1 |
| Completeness [%] | 93.0 | 93 |
| Redundancy | 4.5 | 4.3 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 4.6 | 293 | 16% polyethylene glycol 4000, 0.2 M ammonium acetate, 0.1 M sodium acetate, pH 4.6; , VAPOR DIFFUSION, HANGING DROP, temperature 293K |
