4ZV7
Crystal structure of hexagonal form of lipase B from Candida antarctica
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | ROTATING ANODE |
Source details | RIGAKU |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2015-03-29 |
Detector | OXFORD TITAN CCD |
Wavelength(s) | 1.54 |
Spacegroup name | P 63 2 2 |
Unit cell lengths | 89.034, 89.034, 137.257 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 77.110 - 2.000 |
R-factor | 0.14654 |
Rwork | 0.144 |
R-free | 0.19276 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 3w9b |
RMSD bond length | 0.020 |
RMSD bond angle | 1.964 |
Data reduction software | CrysalisPro |
Data scaling software | Aimless |
Phasing software | PHASER |
Refinement software | REFMAC (5.8.0103) |
Data quality characteristics
Overall | |
Low resolution limit [Å] | 77.110 |
High resolution limit [Å] | 2.000 |
Number of reflections | 22034 |
<I/σ(I)> | 24.58 |
Completeness [%] | 98.1 |
Redundancy | 8.8 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 5.5 | 294.15 | 24% polyethylene glycol 3350, 0.1M citric acid, and 0.1M sodium acetate |