1ZP8
HIV Protease with inhibitor AB-2
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 | 2003-08-07 |
Detector | MAR CCD 165 mm |
Wavelength(s) | 1.0089 |
Spacegroup name | P 61 2 2 |
Unit cell lengths | 63.100, 63.100, 82.100 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 10.000 - 2.020 |
R-factor | 0.197 |
Rwork | 0.197 |
R-free | 0.32600 |
Structure solution method | REFINEMENT |
Starting model (for MR) | 3tlh |
RMSD bond length | 0.012 |
RMSD bond angle | 0.042 |
Data reduction software | DENZO |
Data scaling software | SCALEPACK |
Phasing software | AMoRE |
Refinement software | SHELX |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 50.000 | 2.090 |
High resolution limit [Å] | 2.020 | 2.020 |
Number of reflections | 5931 | |
<I/σ(I)> | 34.4 | 2.94 |
Completeness [%] | 95.9 | 67 |
Redundancy | 10.8 | 2.5 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 5 | 293 | 1.34 M Ammonium Sulfate, 0.1 M Na Acetate, pH 4.8-5.4, pH 5.0, VAPOR DIFFUSION, HANGING DROP, temperature 293K |