5GT5
Structural basis of the specific activity and thermostability of pectate lyase (pelN) from Paenibacillus sp. 0602
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 | 2015-05-08 |
Detector | Nonius Kappa CCD |
Wavelength(s) | 0.9791 |
Spacegroup name | P 1 |
Unit cell lengths | 53.552, 55.584, 83.182 |
Unit cell angles | 74.26, 84.40, 73.51 |
Refinement procedure
Resolution | 34.431 - 1.449 |
R-factor | 0.1507 |
Rwork | 0.149 |
R-free | 0.17300 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 3zsc |
RMSD bond length | 0.011 |
RMSD bond angle | 1.374 |
Data reduction software | HKL-3000 |
Data scaling software | HKL-3000 |
Phasing software | CNS |
Refinement software | PHENIX (1.8.2_1309) |
Data quality characteristics
Overall | |
Low resolution limit [Å] | 50.000 |
High resolution limit [Å] | 1.440 |
Number of reflections | 629583 |
<I/σ(I)> | 14.6 |
Completeness [%] | 99.8 |
Redundancy | 7.4 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 298.15 | 10% PEG 3000, 100mM Na2HPO4 |