2BKS
crystal structure of Renin-PF00074777 complex
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | APS BEAMLINE 17-ID |
Synchrotron site | APS |
Beamline | 17-ID |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2003-07-09 |
Detector | ADSC CCD |
Spacegroup name | P 21 3 |
Unit cell lengths | 141.916, 141.916, 141.916 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 25.000 - 2.200 |
R-factor | 0.2432 |
Rwork | 0.243 |
R-free | 0.28440 |
Structure solution method | MOLECULAR REPLACEMENT |
RMSD bond length | 0.006 |
RMSD bond angle | 1.390 |
Refinement software | CNS |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 50.000 | 2.280 |
High resolution limit [Å] | 2.200 | 2.200 |
Rmerge | 0.070 | 0.220 |
Number of reflections | 47471 | |
<I/σ(I)> | 39 | 6 |
Completeness [%] | 98.0 | 90 |
Redundancy | 13 | 7.1 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | 6 | pH 6.00 |