8G95
Adenylation domain structure from NRPS-like Delta-Poly-L-Ornithine synthetase
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SSRL BEAMLINE BL12-2 |
Synchrotron site | SSRL |
Beamline | BL12-2 |
Temperature [K] | 110 |
Detector technology | PIXEL |
Collection date | 2018-02-11 |
Detector | DECTRIS PILATUS 6M |
Wavelength(s) | 0.97946 |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 64.363, 94.104, 152.947 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 50.180 - 2.200 |
R-factor | 0.2079 |
Rwork | 0.207 |
R-free | 0.22630 |
Structure solution method | MOLECULAR REPLACEMENT |
RMSD bond length | 0.003 |
RMSD bond angle | 0.557 |
Data reduction software | AutoProcess |
Data scaling software | Aimless |
Phasing software | PHASER |
Refinement software | PHENIX (1.13_2998) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 80.150 | 2.273 |
High resolution limit [Å] | 2.195 | 2.195 |
Rmerge | 0.125 | 1.320 |
Rpim | 0.037 | 0.380 |
Number of reflections | 48260 | 4757 |
<I/σ(I)> | 12.58 | 2.29 |
Completeness [%] | 99.8 | |
Redundancy | 12.6 | |
CC(1/2) | 0.997 | 0.860 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | MICROBATCH | 7 | 293.15 | 0.1 M Amm Bromide, 0.1 M BTP pH 7.0, 24% PEG 20K |