5G1Z
Plasmodium vivax N-myristoyltransferase in complex with a quinoline inhibitor (compound 1)
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | DIAMOND BEAMLINE I03 |
Synchrotron site | Diamond |
Beamline | I03 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2011-12-12 |
Detector | ADSC CCD |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 57.400, 118.900, 175.300 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 59.450 - 1.500 |
R-factor | 0.15113 |
Rwork | 0.149 |
R-free | 0.18719 |
Structure solution method | OTHER |
Starting model (for MR) | NONE |
RMSD bond length | 0.025 |
RMSD bond angle | 2.365 |
Data reduction software | XDS |
Data scaling software | SCALA |
Refinement software | REFMAC (5.8.0135) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 59.000 | 1.530 |
High resolution limit [Å] | 1.500 | 1.500 |
Rmerge | 0.070 | 0.630 |
Number of reflections | 191010 | |
<I/σ(I)> | 13.3 | 2.2 |
Completeness [%] | 99.4 | 99.3 |
Redundancy | 6.3 | 4.3 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | 6 | 0.2 M AS, 25% PEG 3350, 0.1 M BIS-TRIS PH 6.0 |