7EBO
Crystal structure of a feruloyl esterase LP_0796 from Lactobacillus plantarum
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SSRF BEAMLINE BL17U1 |
Synchrotron site | SSRF |
Beamline | BL17U1 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2019-11-07 |
Detector | ADSC QUANTUM 315r |
Wavelength(s) | 0.9792 |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 54.891, 74.339, 110.726 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 49.180 - 2.500 |
R-factor | 0.2032 |
Rwork | 0.201 |
R-free | 0.23920 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 1tqh |
RMSD bond length | 0.003 |
RMSD bond angle | 0.725 |
Data scaling software | HKL-2000 |
Phasing software | PHASER |
Refinement software | PHENIX (1.12_2829) |
Data quality characteristics
Overall | Inner shell | Outer shell | |
Low resolution limit [Å] | 50.000 | 4.740 | 2.280 |
High resolution limit [Å] | 2.200 | 3.760 | 2.200 |
Rmerge | 0.112 | 0.070 | 0.486 |
Rmeas | 0.118 | 0.074 | 0.520 |
Rpim | 0.037 | 0.025 | 0.183 |
Total number of observations | 223710 | ||
Number of reflections | 21091 | 1936 | 2161 |
<I/σ(I)> | 9 | ||
Completeness [%] | 96.2 | 86.2 | 100 |
Redundancy | 10.6 | 8.8 | 7.6 |
CC(1/2) | 0.997 | 0.933 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 298 | 0.2 M ammonium sulfate, 0.1 M MES pH 6.5 and 25% polyethylene glycol 8000 |