7XBS
Crystal structure of the adenylation domain of CmnG
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | NSRRC BEAMLINE TPS 05A |
Synchrotron site | NSRRC |
Beamline | TPS 05A |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2021-03-10 |
Detector | RAYONIX MX300-HS |
Wavelength(s) | 1 |
Spacegroup name | P 41 21 2 |
Unit cell lengths | 77.410, 77.410, 191.664 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 27.370 - 1.640 |
R-factor | 0.2059 |
Rwork | 0.205 |
R-free | 0.22770 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 4ea3 |
Data reduction software | HKL-2000 |
Data scaling software | SCALA |
Phasing software | MOLREP |
Refinement software | PHENIX (1.19.2_4158) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 30.000 | 1.700 |
High resolution limit [Å] | 1.640 | 1.640 |
Number of reflections | 72342 | 7125 |
<I/σ(I)> | 38.24 | 4 |
Completeness [%] | 99.9 | 100 |
Redundancy | 8.5 | 8.4 |
CC(1/2) | 0.980 | 0.916 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 293 | 30% w/v PEG-400, and 100 mM CHES/Sodium hydroxide, pH 9.5 |