5HJ9
Crystal structure of Leishmania mexicana arginase in complex with inhibitor ABHPE
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | NSLS BEAMLINE X29A |
| Synchrotron site | NSLS |
| Beamline | X29A |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2014-03-24 |
| Detector | ADSC QUANTUM 315 |
| Wavelength(s) | 1.075 |
| Spacegroup name | H 3 |
| Unit cell lengths | 89.092, 89.092, 113.600 |
| Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
| Resolution | 36.529 - 1.280 |
| R-factor | 0.1507 |
| Rwork | 0.146 |
| R-free | 0.15940 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 4ity |
| RMSD bond length | 0.010 |
| RMSD bond angle | 1.302 |
| Data reduction software | HKL-2000 |
| Data scaling software | HKL-2000 |
| Phasing software | PHASER |
| Refinement software | PHENIX (1.8.3_1479) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 50.000 | |
| High resolution limit [Å] | 1.280 | 1.280 |
| Rmerge | 0.091 | |
| Rpim | 0.509 | |
| Number of reflections | 86060 | |
| <I/σ(I)> | 29.3 | 1.2 |
| Completeness [%] | 99.3 | 94.6 |
| Redundancy | 12.1 | 8.5 |
| CC(1/2) | 0.510 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 294 | 0.1 M HEPES, pH 7.5, 25% PEG3350 |
