6WCN
Crystal structure of Laccase from Thermus thermophilus HB27 with an open conformation of beta-hairpin (Average deposited dose 18.08 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) | 1.1949 |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 54.482, 60.819, 76.201 |
Unit cell angles | 90.00, 109.30, 90.00 |
Refinement procedure
Resolution | 39.270 - 1.700 |
R-factor | 0.1976 |
Rwork | 0.195 |
R-free | 0.24210 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 2xu9 |
Data reduction software | MOSFLM |
Data scaling software | SCALA |
Phasing software | PHASER (7.0.076) |
Refinement software | PHENIX (1.17.1_3660) |
Data quality characteristics
Overall | Inner shell | Outer shell | |
Low resolution limit [Å] | 39.270 | 39.280 | 1.760 |
High resolution limit [Å] | 1.700 | 3.660 | 1.700 |
Rmerge | 0.052 | 0.027 | 0.790 |
Rmeas | 0.074 | 0.039 | 1.000 |
Rpim | 0.052 | 0.027 | 0.790 |
Number of reflections | 51864 | 5310 | 5155 |
<I/σ(I)> | 6.55 | 16.4 | 1 |
Completeness [%] | 100.0 | 99.9 | 100 |
Redundancy | 1.9 | 1.9 | 1.8 |
CC(1/2) | 0.996 | 0.995 | 0.313 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | MICROBATCH | 5.5 | 277.15 | 20% PEG 4000, 20% 2-propanol, 100 mMcitrate buffer |