3NGT
Structure of Leishmania NDKb complexed with AMP.
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | LNLS BEAMLINE W01B-MX2 |
Synchrotron site | LNLS |
Beamline | W01B-MX2 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2010-04-12 |
Detector | MARMOSAIC 225 mm CCD |
Wavelength(s) | 1.458 |
Spacegroup name | H 3 2 |
Unit cell lengths | 233.949, 233.949, 265.335 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 161.000 - 2.570 |
R-factor | 0.24127 |
Rwork | 0.237 |
R-free | 0.31359 |
Structure solution method | MOLECULAR REPLACEMENT |
RMSD bond length | 0.016 |
RMSD bond angle | 1.816 |
Data reduction software | HKL-2000 |
Data scaling software | HKL-2000 |
Phasing software | PHASER |
Refinement software | REFMAC (5.5.0102) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 161.000 | 2.660 |
High resolution limit [Å] | 2.570 | 2.570 |
Rmerge | 0.088 | 0.350 |
Number of reflections | 86594 | |
<I/σ(I)> | 1.8 | |
Completeness [%] | 97.9 | 99.8 |
Redundancy | 3.5 | 3.4 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 291 | sodium/potassium phosphate, VAPOR DIFFUSION, SITTING DROP, temperature 291K |