6BJE
Crystal Structure of Lysophospholipase A2 Conjugated with Phenylmethylsulfonyl Fluoride
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | APS BEAMLINE 24-ID-E |
Synchrotron site | APS |
Beamline | 24-ID-E |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2014-06-16 |
Detector | ADSC QUANTUM 315r |
Wavelength(s) | 0.97918 |
Spacegroup name | P 43 21 2 |
Unit cell lengths | 54.769, 54.769, 279.619 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 69.905 - 2.700 |
R-factor | 0.2256 |
Rwork | 0.221 |
R-free | 0.26410 |
RMSD bond length | 0.003 |
RMSD bond angle | 0.695 |
Data reduction software | XDS |
Data scaling software | Aimless (0.1.27) |
Phasing software | PHASER |
Refinement software | PHENIX ((1.12_2829: ???)) |
Data quality characteristics
Overall | Inner shell | Outer shell | |
Low resolution limit [Å] | 139.810 | 139.810 | 2.810 |
High resolution limit [Å] | 2.660 | 8.420 | 2.660 |
Rmerge | 0.125 | ||
Rmeas | 0.131 | ||
Rpim | 0.145 | 0.039 | 0.507 |
Number of reflections | 12993 | 535 | 1618 |
<I/σ(I)> | 7.6 | ||
Completeness [%] | 98.4 | 100 | 88.7 |
Redundancy | 12 | 10.3 | 9.9 |
CC(1/2) | 0.988 | 0.998 | 0.565 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 6.5 | 293 | 0.1 M NaCitric pH 5.6, 15% PEG-3350 |