2XVP
ChiA1 from Aspergillus fumigatus, apostructure
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | ESRF BEAMLINE ID14-3 |
| Synchrotron site | ESRF |
| Beamline | ID14-3 |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2007-04-11 |
| Detector | ADSC QUANTUM 4r |
| Spacegroup name | I 21 21 21 |
| Unit cell lengths | 76.729, 126.077, 213.412 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 19.920 - 2.000 |
| R-factor | 0.20356 |
| Rwork | 0.202 |
| R-free | 0.24174 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 2uy2 |
| RMSD bond length | 0.016 |
| RMSD bond angle | 1.394 |
| Data reduction software | DENZO |
| Data scaling software | SCALEPACK |
| Phasing software | AMoRE |
| Refinement software | REFMAC (5.5.0088) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 20.000 | 2.050 |
| High resolution limit [Å] | 2.000 | 2.000 |
| Rmerge | 0.100 | 0.440 |
| Number of reflections | 69723 | |
| <I/σ(I)> | 10.8 | 2.6 |
| Completeness [%] | 100.0 | 100 |
| Redundancy | 4.1 | 4 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | 0.42M-0.58M NAH2PO4, 0.83M-0.74M K2HPO4 |
