6AYM
Crystal structure of Campylobacter jejuni 5'-methylthioadenosine/S-adenosyl homocysteine nucleosidase (MTAN)
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | APS BEAMLINE 31-ID |
Synchrotron site | APS |
Beamline | 31-ID |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2017-06-14 |
Detector | RAYONIX MX-225 |
Wavelength(s) | 0.97931 |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 46.408, 84.620, 124.881 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 70.050 - 1.250 |
R-factor | 0.19041 |
Rwork | 0.190 |
R-free | 0.20532 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 4wkn |
RMSD bond length | 0.008 |
RMSD bond angle | 1.335 |
Data reduction software | iMOSFLM |
Data scaling software | Aimless |
Phasing software | PHASER |
Refinement software | REFMAC (5.8.0158) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 70.050 | 1.270 |
High resolution limit [Å] | 1.250 | 1.250 |
Number of reflections | 134158 | 6445 |
<I/σ(I)> | 14.8 | 1.9 |
Completeness [%] | 98.3 | 96.5 |
Redundancy | 7.3 | 7.4 |
CC(1/2) | 0.990 | 0.650 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 6.5 | 295 | 100 mM MES pH 6.5, 600 mM Sodium Chloride, 20% (w/v) PEG 4000 |