5JR9
Crystal structure of apo-NeC3PO
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SSRF BEAMLINE BL17U |
Synchrotron site | SSRF |
Beamline | BL17U |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2014-10-10 |
Detector | RAYONIX MX-225 |
Wavelength(s) | 1.000 |
Spacegroup name | P 1 |
Unit cell lengths | 86.438, 92.712, 92.745 |
Unit cell angles | 114.29, 113.39, 95.76 |
Refinement procedure
Resolution | 30.000 - 2.400 |
R-factor | 0.2298 |
Rwork | 0.229 |
R-free | 0.25157 |
Structure solution method | MOLECULAR REPLACEMENT |
RMSD bond length | 0.008 |
RMSD bond angle | 1.358 |
Data reduction software | HKL-2000 |
Data scaling software | HKL-2000 |
Phasing software | PHASER |
Refinement software | REFMAC (5.7.0029) |
Data quality characteristics
Overall | |
Low resolution limit [Å] | 30.000 |
High resolution limit [Å] | 2.400 |
Number of reflections | 80578 |
<I/σ(I)> | 16.5 |
Completeness [%] | 95.4 |
Redundancy | 2.5 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 290 | 5% v/v tacsimate (pH 7.0), 0.1 M HEPES (pH 7.0), 10% w/v PEG monomethyl ether 5,000 |