1SL7
Crystal structure of calcium-loaded apo-obelin from Obelia longissima
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | APS BEAMLINE 22-ID |
Synchrotron site | APS |
Beamline | 22-ID |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2003-03-20 |
Detector | MAR CCD 165 mm |
Wavelength(s) | 0.97 |
Spacegroup name | P 41 21 2 |
Unit cell lengths | 58.641, 58.641, 110.378 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 51.990 - 2.200 |
R-factor | 0.18856 |
Rwork | 0.186 |
R-free | 0.23938 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 1jf2 |
RMSD bond length | 0.014 |
RMSD bond angle | 1.307 |
Data reduction software | HKL-2000 |
Data scaling software | SCALEPACK |
Phasing software | AMoRE |
Refinement software | REFMAC (5.1.24) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 50.000 | 2.280 |
High resolution limit [Å] | 2.200 | 2.200 |
Rmerge | 0.074 | 0.251 |
Number of reflections | 18694 | |
<I/σ(I)> | 20.4 | 4.7 |
Completeness [%] | 99.4 | |
Redundancy | 5.9 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | modified microbatch | 7.5 | 277 | 20% w/v polyethylene glycol 10000, 0.1M HEPES, pH 7.5, modified microbatch, temperature 277K |