1C1J
STRUCTURE OF CADMIUM-SUBSTITUTED PHOSPHOLIPASE A2 FROM AGKISTRONDON HALYS PALLAS AT 2.8 ANGSTROMS RESOLUTION
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | ROTATING ANODE |
Source details | SIEMENS |
Temperature [K] | 280 |
Detector technology | AREA DETECTOR |
Collection date | 1998-03-17 |
Detector | XENTRONICS |
Spacegroup name | C 1 2 1 |
Unit cell lengths | 100.180, 54.010, 108.490 |
Unit cell angles | 90.00, 111.59, 90.00 |
Refinement procedure
Resolution | 8.000 - 2.800 |
Rwork | 0.201 |
R-free | 0.28200 |
RMSD bond length | 0.008 |
RMSD bond angle | 1.230 |
Data reduction software | DENZO |
Data scaling software | SCALEPACK |
Phasing software | AMoRE |
Refinement software | X-PLOR (3.851) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 20.000 | 2.900 |
High resolution limit [Å] | 2.800 | 2.800 |
Rmerge | 0.108 | 0.370 |
Number of reflections | 13017 | |
<I/σ(I)> | 11.6 | |
Completeness [%] | 96.2 | 95 |
Redundancy | 3.3 | 3.2 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 8.5 | 291 | PEG 4000, n-octyl beta-D-glycopyranoside, CaCl2, pH 8.5, VAPOR DIFFUSION, HANGING DROP at 291K |