3CH7
Crystal structure of 6-phosphogluconolactonase from Leishmania braziliensis
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SSRL BEAMLINE BL9-2 |
| Synchrotron site | SSRL |
| Beamline | BL9-2 |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2007-05-16 |
| Detector | MARMOSAIC 325 mm CCD |
| Wavelength(s) | 0.91840 |
| Spacegroup name | C 2 2 21 |
| Unit cell lengths | 69.967, 88.490, 100.523 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 40.000 - 2.290 |
| R-factor | 0.192 |
| Rwork | 0.190 |
| R-free | 0.24900 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 2j0e |
| RMSD bond length | 0.020 |
| RMSD bond angle | 1.799 |
| Data reduction software | DENZO |
| Data scaling software | SCALEPACK |
| Phasing software | MOLREP |
| Refinement software | REFMAC (5.4.0066) |
Data quality characteristics
| Overall | Inner shell | Outer shell | |
| Low resolution limit [Å] | 50.000 | 50.000 | 2.370 |
| High resolution limit [Å] | 2.290 | 4.930 | 2.290 |
| Rmerge | 0.069 | 0.035 | 0.338 |
| Number of reflections | 13966 | ||
| <I/σ(I)> | 13.9 | ||
| Completeness [%] | 96.5 | 99.8 | 82 |
| Redundancy | 6.9 | 6.9 | 5.4 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION | 7.5 | 298 | 40% PEG 1000, 0.1 M MOPS, 0.1 M NH4H2PO4, pH 7.5, VAPOR DIFFUSION, temperature 298K |
