6VLX
Crystal structure of FabI from Alistipes finegoldii
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | APS BEAMLINE 22-ID |
Synchrotron site | APS |
Beamline | 22-ID |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2018-06-12 |
Detector | DECTRIS EIGER X 16M |
Wavelength(s) | 0.9790 |
Spacegroup name | P 21 2 21 |
Unit cell lengths | 60.557, 77.772, 127.561 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 29.520 - 1.720 |
R-factor | 0.2082 |
Rwork | 0.206 |
R-free | 0.24480 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 2p91 |
RMSD bond length | 0.006 |
RMSD bond angle | 1.380 |
Data reduction software | HKL-2000 |
Data scaling software | HKL-2000 |
Phasing software | PHASER |
Refinement software | REFMAC (5.8.0258) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 35.000 | 1.760 |
High resolution limit [Å] | 1.720 | 1.720 |
Number of reflections | 62918 | 2748 |
<I/σ(I)> | 13.4 | 1.8 |
Completeness [%] | 98.3 | |
Redundancy | 6.4 | 5.4 |
CC(1/2) | 0.997 | 0.909 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 293.15 | Crystallization: 1.2 M Na K Tartrate, 100 mM Tris pH 8.0, Cryo: 1.3M Na K Tartrate, 100 mM Tris pH 8.0, 20% glycerol |