2YIL
Crystal Structure of Parasite Sarcocystis muris Lectin SML-2
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | EMBL/DESY, HAMBURG BEAMLINE X12 |
Synchrotron site | EMBL/DESY, HAMBURG |
Beamline | X12 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2006-11-11 |
Detector | MARMOSAIC 225 mm CCD |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 53.170, 129.040, 158.100 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 33.440 - 1.950 |
R-factor | 0.16981 |
Rwork | 0.168 |
R-free | 0.19716 |
Structure solution method | SAD |
Starting model (for MR) | NONE |
RMSD bond length | 0.016 |
RMSD bond angle | 1.491 |
Data reduction software | XDS |
Data scaling software | XSCALE |
Phasing software | SHELXCD |
Refinement software | REFMAC (5.5.0109) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 35.000 | 2.000 |
High resolution limit [Å] | 1.950 | 1.950 |
Rmerge | 0.060 | 0.420 |
Number of reflections | 79584 | |
<I/σ(I)> | 23.8 | 4.2 |
Completeness [%] | 99.5 | 96.5 |
Redundancy | 7.2 | 6.4 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 7.9 | 291 | VAPOR DIFFUSION, HANGING DROP. TEMPERATURE 291K. PROTEIN SOLUTION:50 MM TRIS-HCL, 150 MM NACL, PH 8.3, 12 MG/ML SML-2. RESERVOIR: 0.1 M HEPES, PH 7.5, 0.1 M NACL, 1.7 M AMMONIUM SULFATE, 15% GLYCEROL. DROPLET: 1 MICROLITER PROTEIN SOLUTION: 1 MICROLITER RESERVOIR SOLUTION. |