1S0Q
Native Bovine Pancreatic Trypsin
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | ESRF BEAMLINE BM14 |
Synchrotron site | ESRF |
Beamline | BM14 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2001-11-08 |
Detector | MARRESEARCH |
Wavelength(s) | 1.02 |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 54.383, 58.710, 66.427 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 20.000 - 1.020 |
R-factor | 0.1122 |
Rwork | 0.111 |
R-free | 0.14160 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 1j8a |
RMSD bond length | 0.016 |
RMSD bond angle | 0.031 |
Data reduction software | HKL-2000 |
Data scaling software | SCALEPACK |
Phasing software | EPMR |
Refinement software | SHELXL-97 |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 20.000 | 1.060 |
High resolution limit [Å] | 1.020 | 1.020 |
Number of reflections | 101386 | |
Completeness [%] | 93.5 | 77.3 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 8 | PEG 6000, Ammonium Sulphate, Calcium Chloride, TRIS-HCl, pH 8, VAPOR DIFFUSION, HANGING DROP, temperature 100K |