6ARH
Crystal structure of Human NAL at a resolution of 1.6 Angstrom
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | AUSTRALIAN SYNCHROTRON BEAMLINE MX1 |
Synchrotron site | Australian Synchrotron |
Beamline | MX1 |
Temperature [K] | 110 |
Detector technology | CCD |
Collection date | 2017-04-01 |
Detector | ADSC QUANTUM 210r |
Wavelength(s) | 0.9537 |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 96.988, 106.897, 127.027 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 49.270 - 1.600 |
R-factor | 0.1656 |
Rwork | 0.164 |
R-free | 0.18860 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 5afd |
RMSD bond length | 0.008 |
RMSD bond angle | 1.304 |
Data reduction software | XDS |
Data scaling software | Aimless (0.5.32) |
Phasing software | PHASER |
Refinement software | REFMAC |
Data quality characteristics
Overall | Inner shell | Outer shell | |
Low resolution limit [Å] | 49.270 | 49.270 | 1.630 |
High resolution limit [Å] | 1.600 | 8.760 | 1.600 |
Rmerge | 0.090 | 0.037 | 1.297 |
Rmeas | 0.097 | 0.041 | 1.436 |
Rpim | 0.037 | 0.017 | 0.607 |
Number of reflections | 173953 | 1206 | 8543 |
<I/σ(I)> | 10.4 | ||
Completeness [%] | 100.0 | 99.6 | 100 |
Redundancy | 6.8 | 5.8 | 5.5 |
CC(1/2) | 0.998 | 0.996 | 0.507 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION | 7.5 | 291 | 25% PEG3350, 0.2 M sodium acetate, 0.1 M HEPES, pH 7.5 |