3B7P
Crystal structure of spermidine synthase from Plasmodium falciparum in complex with spermine
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | ROTATING ANODE |
Source details | RIGAKU FR-E+ SUPERBRIGHT |
Temperature [K] | 100 |
Detector technology | IMAGE PLATE |
Collection date | 2007-05-27 |
Detector | RIGAKU RAXIS IV |
Wavelength(s) | 1.5418 |
Spacegroup name | C 1 2 1 |
Unit cell lengths | 199.483, 134.584, 48.370 |
Unit cell angles | 90.00, 96.36, 90.00 |
Refinement procedure
Resolution | 29.440 - 2.000 |
R-factor | 0.21634 |
Rwork | 0.215 |
R-free | 0.24978 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 2pwp |
RMSD bond length | 0.011 |
RMSD bond angle | 1.325 |
Data reduction software | HKL-2000 |
Data scaling software | HKL-2000 |
Phasing software | PHASES |
Refinement software | REFMAC (5.2.0019) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 30.000 | 2.070 |
High resolution limit [Å] | 2.000 | 2.000 |
Number of reflections | 84798 | |
<I/σ(I)> | 16.67 | 2.21 |
Completeness [%] | 98.5 | 90.8 |
Redundancy | 3.4 | 3.2 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION | 5.5 | 291 | 25% w/v PEG 3350, 0.1M Ammonium sulfate, 0.1M Bis-tris, pH 5.5, VAPOR DIFFUSION, temperature 291K |