4CA8
Drosophila Angiotensin converting enzyme (AnCE) in complex with a phosphinic tripeptide FII
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | DIAMOND BEAMLINE I04 |
| Synchrotron site | Diamond |
| Beamline | I04 |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2010-02-20 |
| Detector | ADSC QUANTUM 315 |
| Spacegroup name | H 3 |
| Unit cell lengths | 172.890, 172.890, 100.480 |
| Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
| Resolution | 49.360 - 1.990 |
| R-factor | 0.19468 |
| Rwork | 0.194 |
| R-free | 0.21640 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 2x8y |
| RMSD bond length | 0.008 |
| RMSD bond angle | 1.193 |
| Data reduction software | MOSFLM |
| Data scaling software | SCALA |
| Phasing software | PHASER |
| Refinement software | REFMAC (5.7.0029) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 49.310 | 2.100 |
| High resolution limit [Å] | 1.990 | 1.990 |
| Rmerge | 0.100 | 0.600 |
| Number of reflections | 74339 | |
| <I/σ(I)> | 6.7 | 1.5 |
| Completeness [%] | 96.8 | 95.4 |
| Redundancy | 2.6 | 2.3 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | 7.5 | 100 MM HEPES 7.5, 1.3 M SODIUM CITRATE |
