2J6P
STRUCTURE OF AS-SB REDUCTASE FROM LEISHMANIA MAJOR
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | ESRF BEAMLINE ID23-1 |
Synchrotron site | ESRF |
Beamline | ID23-1 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2005-04-20 |
Detector | MARRESEARCH |
Spacegroup name | P 32 2 1 |
Unit cell lengths | 111.824, 111.824, 177.384 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 65.370 - 2.150 |
R-factor | 0.193 |
Rwork | 0.190 |
R-free | 0.24100 |
Structure solution method | SIRAS |
Starting model (for MR) | NONE |
RMSD bond length | 0.047 |
RMSD bond angle | 2.881 |
Data reduction software | MOSFLM |
Data scaling software | SCALA |
Phasing software | SOLVE-RESOLVE |
Refinement software | REFMAC (5.2.0005) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 65.410 | 2.270 |
High resolution limit [Å] | 2.150 | 2.150 |
Rmerge | 0.070 | 0.160 |
Number of reflections | 68637 | |
<I/σ(I)> | 18.5 | 7.3 |
Completeness [%] | 97.4 | 93.2 |
Redundancy | 4.8 | 4.7 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | 8 | 2.0 M (NH4)SO4, 100 MM HEPES PH 8.0, 15 MM NA2S2O3 |