5NTH
Structure of Leucyl aminopeptidase from Leishmania major in complex with actinonin
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | DIAMOND BEAMLINE I24 |
Synchrotron site | Diamond |
Beamline | I24 |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2013-09-30 |
Detector | DECTRIS PILATUS 6M |
Wavelength(s) | 0.97781 |
Spacegroup name | P 3 2 1 |
Unit cell lengths | 116.439, 116.439, 91.491 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 38.110 - 2.500 |
R-factor | 0.19649 |
Rwork | 0.194 |
R-free | 0.24486 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 5nsk |
RMSD bond length | 0.013 |
RMSD bond angle | 1.642 |
Data reduction software | MOSFLM |
Data scaling software | Aimless |
Phasing software | PHASER |
Refinement software | REFMAC (5.8.0135) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 38.110 | 2.600 |
High resolution limit [Å] | 2.500 | 2.500 |
Rmerge | 0.150 | 0.747 |
Number of reflections | 21850 | |
<I/σ(I)> | 8.2 | 2 |
Completeness [%] | 87.8 | 90.2 |
Redundancy | 5.7 | 5.6 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 293 | 0.8 M Succinic acid pH 7.0, 3 % (w/v) 1,5-Diamino-pentane di-hydrochloride, 5 mM MnSO4, 5 mM actinonin |