4AJU
Crystal structure of the reactive loop cleaved ZPI in P41 space group
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | DIAMOND BEAMLINE I03 |
| Synchrotron site | Diamond |
| Beamline | I03 |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Detector | ADSC CCD |
| Spacegroup name | P 41 |
| Unit cell lengths | 100.698, 100.698, 78.972 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 100.500 - 2.650 |
| R-factor | 0.21754 |
| Rwork | 0.215 |
| R-free | 0.25766 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 7api |
| RMSD bond length | 0.007 |
| RMSD bond angle | 1.021 |
| Data reduction software | MOSFLM |
| Data scaling software | SCALEPACK |
| Phasing software | PHASER |
| Refinement software | REFMAC (5.5.0099) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 100.260 | 2.790 |
| High resolution limit [Å] | 2.650 | 2.650 |
| Rmerge | 0.070 | 0.720 |
| Number of reflections | 22072 | |
| <I/σ(I)> | 9.9 | 1.5 |
| Completeness [%] | 95.8 | 82.2 |
| Redundancy | 3 | 2.8 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | 4.5 | 10% 2-PROPANOL, 0.2M LI2SO4, 0.1M NAAC, PH4.5 |
