3JQQ
Crystal structure of the H286K mutant of Ferredoxin-NADP+ reductase from Plasmodium falciparum in complex with 2'P-AMP
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | ESRF BEAMLINE ID23-1 |
| Synchrotron site | ESRF |
| Beamline | ID23-1 |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2008-08-30 |
| Detector | ADSC QUANTUM 315 |
| Spacegroup name | P 31 |
| Unit cell lengths | 124.243, 124.243, 134.255 |
| Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
| Resolution | 62.120 - 2.200 |
| R-factor | 0.25879 |
| Rwork | 0.256 |
| R-free | 0.30797 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 2ok7 |
| RMSD bond length | 0.006 |
| RMSD bond angle | 1.012 |
| Data reduction software | MOSFLM |
| Data scaling software | SCALA |
| Phasing software | MOLREP |
| Refinement software | REFMAC (5.5.0066) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 83.918 | 2.320 |
| High resolution limit [Å] | 2.100 | 2.200 |
| Rmerge | 0.114 | 0.564 |
| Number of reflections | 117739 | |
| <I/σ(I)> | 9.9 | 1.8 |
| Completeness [%] | 100.0 | 100 |
| Redundancy | 3.1 | 3.1 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | Microbatch with permeable oil | 5.4 | 293 | 20% isopropanol, 20% PEG 4000, 0.1M citrate-NaOH, 2mM 2'P-AMP(Cocrystallization), pH 5.4, Microbatch with permeable oil, temperature 293K |
