7LL3
S-adenosylmethionine synthetase co-crystallized with UppNHp
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | AUSTRALIAN SYNCHROTRON BEAMLINE MX2 |
Synchrotron site | Australian Synchrotron |
Beamline | MX2 |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2019-08-28 |
Detector | DECTRIS EIGER X 16M |
Wavelength(s) | 0.9537 |
Spacegroup name | P 61 2 2 |
Unit cell lengths | 123.655, 123.655, 289.409 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 43.980 - 2.240 |
R-factor | 0.2126 |
Rwork | 0.211 |
R-free | 0.23410 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 1p7l |
RMSD bond length | 0.004 |
RMSD bond angle | 0.588 |
Data reduction software | XDS |
Data scaling software | SCALA |
Phasing software | PHASER |
Refinement software | PHENIX (1.17.1_3660) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 43.980 | 2.300 |
High resolution limit [Å] | 2.240 | 2.240 |
Number of reflections | 63722 | 4401 |
<I/σ(I)> | 19.6 | |
Completeness [%] | 100.0 | |
Redundancy | 32.8 | |
CC(1/2) | 1.000 | 0.385 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 292.15 | 8% PEG 8000, 0.1 M Bis-Tris pH 6.5, 20% ethylene glycol |