6W9X
Crystal structure of Laccase from Thermus thermophilus HB27 with an open conformation of beta-hairpin (Average deposited dose 5.1 MGy)
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | APS BEAMLINE 19-ID |
Synchrotron site | APS |
Beamline | 19-ID |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2018-04-17 |
Detector | ADSC QUANTUM 315 |
Wavelength(s) | 1.1950 |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 54.521, 60.757, 76.338 |
Unit cell angles | 90.00, 109.52, 90.00 |
Refinement procedure
Resolution | 39.240 - 1.700 |
R-factor | 0.2004 |
Rwork | 0.198 |
R-free | 0.24680 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 2xu9 |
Data reduction software | XDS (Version Jan 26,201) |
Data scaling software | XSCALE (Version Jan 26,201) |
Phasing software | PHASER (7.0.076) |
Refinement software | PHENIX (1.17.1_3660) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 39.240 | 1.760 |
High resolution limit [Å] | 1.700 | 1.700 |
Rmerge | 0.708 | 1.266 |
Rmeas | 0.752 | 1.350 |
Rpim | 0.252 | 0.461 |
Number of reflections | 51847 | 5145 |
<I/σ(I)> | 55.41 | 5.3 |
Completeness [%] | 100.0 | 100 |
Redundancy | 8.7 | 8.6 |
CC(1/2) | 0.750 | 0.539 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | BATCH MODE | 5.5 | 277.15 | 20% PEG 4000, 20% 2-propanol, 100mM citrate buffer |