7KPU
Crystal structure of human NatD (NAA40) bound to a bisubstrate analogue with a C-3 linker
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | APS BEAMLINE 21-ID-E |
Synchrotron site | APS |
Beamline | 21-ID-E |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2020-09-26 |
Detector | DECTRIS EIGER X 16M |
Wavelength(s) | 0.9792 |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 46.317, 74.164, 127.022 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 64.050 - 1.430 |
R-factor | 0.1636 |
Rwork | 0.163 |
R-free | 0.18270 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 4u9w |
RMSD bond length | 0.013 |
RMSD bond angle | 1.489 |
Data reduction software | HKL-2000 |
Data scaling software | HKL-2000 |
Phasing software | PHENIX |
Refinement software | PHENIX (1.14_3260) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 127.020 | 1.450 |
High resolution limit [Å] | 1.430 | 1.430 |
Rmerge | 0.037 | 0.268 |
Rmeas | 0.040 | 0.295 |
Rpim | 0.016 | 0.120 |
Number of reflections | 81356 | 3986 |
<I/σ(I)> | 35.9 | 6.2 |
Completeness [%] | 99.5 | |
Redundancy | 6.5 | |
CC(1/2) | 0.997 | 0.961 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 5.5 | 291 | 0.1 M Bis-tris, pH 5.5, 2M Ammonium sulfate |