3RIV
The Crystal Structure of Leishmania major Peroxidase
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SSRL BEAMLINE BL7-1 |
| Synchrotron site | SSRL |
| Beamline | BL7-1 |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2010-05-15 |
| Detector | ADSC QUANTUM 315r |
| Spacegroup name | P 21 21 21 |
| Unit cell lengths | 46.601, 77.187, 156.022 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 37.464 - 1.760 |
| R-factor | 0.17097 |
| Rwork | 0.169 |
| R-free | 0.20876 |
| Structure solution method | SAD |
| RMSD bond length | 0.015 |
| RMSD bond angle | 1.399 |
| Data reduction software | HKL-2000 |
| Data scaling software | HKL-2000 |
| Phasing software | DM |
| Refinement software | REFMAC (5.5.0109) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 37.464 | 1.790 |
| High resolution limit [Å] | 1.760 | 1.760 |
| Rmerge | 0.074 | 0.180 |
| Number of reflections | 56061 | |
| <I/σ(I)> | 33.22 | 6.01 |
| Completeness [%] | 99.9 | 100 |
| Redundancy | 5 | 4 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 7 | 298 | PEG3350, potassium chloride, glycerol, pH 7.0, VAPOR DIFFUSION, SITTING DROP, temperature 298K |
