7ELF
Nitrilase-Like Protein Nit2 from Kluyve-romyces lactis
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | PAL/PLS BEAMLINE 5C (4A) |
Synchrotron site | PAL/PLS |
Beamline | 5C (4A) |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2019-03-23 |
Detector | ADSC QUANTUM 315 |
Wavelength(s) | 1.000 |
Spacegroup name | C 1 2 1 |
Unit cell lengths | 78.997, 211.065, 89.372 |
Unit cell angles | 90.00, 112.11, 90.00 |
Refinement procedure
Resolution | 45.680 - 2.200 |
R-factor | 0.1691 |
Rwork | 0.168 |
R-free | 0.22250 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 4h5u |
RMSD bond length | 0.009 |
RMSD bond angle | 0.941 |
Data reduction software | HKL-2000 |
Data scaling software | HKL-2000 |
Phasing software | PHENIX |
Refinement software | PHENIX ((1.17.1_3660: ???)) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 50.000 | 2.280 |
High resolution limit [Å] | 2.200 | 2.200 |
Number of reflections | 68559 | 6799 |
<I/σ(I)> | 16.96 | |
Completeness [%] | 99.9 | |
Redundancy | 5.7 | |
CC(1/2) | 0.991 | 0.862 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 277 | 26% w/v polyethylene glycol (PEG 3350), 0.3M Ammonium tartrate dibasic |