4BP3
Crystal Structure of Plasmodium Falciparum Spermidine Synthase in Complex with DECARBOXYLATED S-ADENOSYLMETHIONINE5' AND 4- METHYLANILINE
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | MAX II BEAMLINE I911-2 |
| Synchrotron site | MAX II |
| Beamline | I911-2 |
| Temperature [K] | 110 |
| Detector technology | CCD |
| Collection date | 2013-06-27 |
| Detector | MARRESEARCH 165 MM |
| Spacegroup name | C 1 2 1 |
| Unit cell lengths | 195.460, 132.790, 49.158 |
| Unit cell angles | 90.00, 94.86, 90.00 |
Refinement procedure
| Resolution | 28.660 - 1.750 |
| R-factor | 0.1812 |
| Rwork | 0.180 |
| R-free | 0.21232 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 2i7c |
| RMSD bond length | 0.024 |
| RMSD bond angle | 2.279 |
| Data reduction software | XDS |
| Data scaling software | SCALEPACK |
| Phasing software | MOLREP |
| Refinement software | REFMAC (5.7.0029) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 28.650 | 1.860 |
| High resolution limit [Å] | 1.760 | 1.760 |
| Rmerge | 0.050 | 0.390 |
| Number of reflections | 118398 | |
| <I/σ(I)> | 15.42 | 2.39 |
| Completeness [%] | 93.7 | 78.5 |
| Redundancy | 3.05 | 2.65 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 |
