1GVT
Endothiapepsin complex with CP-80,794
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | ESRF BEAMLINE ID14-2 |
Synchrotron site | ESRF |
Beamline | ID14-2 |
Temperature [K] | 130 |
Detector technology | CCD |
Collection date | 2001-04-01 |
Detector | ADSC CCD |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 42.720, 74.410, 42.520 |
Unit cell angles | 90.00, 97.34, 90.00 |
Refinement procedure
Resolution | 10.000 - 0.980 |
R-factor | 0.11 |
R-free | 0.13140 * |
Structure solution method | OTHER |
RMSD bond length | 0.016 |
RMSD bond angle | 0.031 |
Data reduction software | MOSFLM |
Data scaling software | SCALA |
Refinement software | SHELXL-97 |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 10.000 | 1.030 |
High resolution limit [Å] | 0.980 | 0.980 |
Rmerge | 0.074 * | 0.158 |
Number of reflections | 149856 | |
<I/σ(I)> | 5.2 | 2.3 |
Completeness [%] | 99.5 | 100 |
Redundancy | 4.4 * | 3.4 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | unknown * | 4.5 | PH 4.50 |
Crystallization Reagents in Literatures
ID | crystal ID | solution | reagent name | concentration (unit) | details |
1 | 1 | 1 | enzyme | 2.0 (mg/ml) | |
2 | 1 | 1 | sodium acetate | 100 (mM) |