1M66
Crystal Structure of Leishmania mexicana GPDH Complexed with Inhibitor 2-bromo-6-chloro-purine
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | APS BEAMLINE 19-ID |
| Synchrotron site | APS |
| Beamline | 19-ID |
| Temperature [K] | 125 |
| Detector technology | CCD |
| Collection date | 2001-09-20 |
| Detector | ADSC QUANTUM 4 |
| Wavelength(s) | 1.77 |
| Spacegroup name | P 41 21 2 |
| Unit cell lengths | 70.356, 70.356, 210.794 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 45.180 - 1.900 |
| R-factor | 0.20441 |
| Rwork | 0.204 |
| R-free | 0.22298 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.010 |
| RMSD bond angle | 1.458 |
| Data reduction software | HKL-2000 |
| Data scaling software | SCALEPACK |
| Phasing software | AMoRE |
| Refinement software | REFMAC (5.0) |
Data quality characteristics
| Overall | |
| Low resolution limit [Å] | 50.000 |
| High resolution limit [Å] | 1.900 |
| Rmerge | 0.064 |
| Number of reflections | 41197 |
| <I/σ(I)> | 36.8 |
| Completeness [%] | 96.3 |
| Redundancy | 12.9 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 298 | Na Citrate, TEA, DTT, EDTA, VAPOR DIFFUSION, SITTING DROP, temperature 298.0K |
