3ZOO
Structure of the Y46F mutant of human cytochrome c
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | DIAMOND BEAMLINE I03 |
| Synchrotron site | Diamond |
| Beamline | I03 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2012-07-12 |
| Detector | DECTRIS PILATUS 6M |
| Spacegroup name | P 1 |
| Unit cell lengths | 36.367, 53.952, 58.950 |
| Unit cell angles | 76.55, 88.73, 71.86 |
Refinement procedure
| Resolution | 30.590 - 1.350 |
| R-factor | 0.14035 |
| Rwork | 0.138 |
| R-free | 0.17935 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 3nwv |
| RMSD bond length | 0.017 |
| RMSD bond angle | 1.990 |
| Data reduction software | XDS |
| Data scaling software | SCALA |
| Refinement software | REFMAC (5.7.0029) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 30.600 | 1.420 |
| High resolution limit [Å] | 1.350 | 1.350 |
| Rmerge | 0.070 | 0.420 |
| Number of reflections | 86068 | |
| <I/σ(I)> | 8.7 | 2.3 |
| Completeness [%] | 94.8 | 86.5 |
| Redundancy | 3.6 | 3.3 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | 7 | 26-31% (W/V) PEG 1000, 40 MM KH2PO4 PH 7.0 |
