1ZDP
Crystal Structure Analysis of Thermolysin Complexed with the Inhibitor (S)-thiorphan
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | ROTATING ANODE |
Source details | ELLIOTT GX-21 |
Temperature [K] | 298 |
Detector technology | FILM |
Collection date | 1987 |
Detector | KODAK |
Wavelength(s) | 1.5418 |
Spacegroup name | P 61 2 2 |
Unit cell lengths | 94.000, 94.000, 132.100 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 10.000 - 1.700 |
R-factor | 0.183 |
Rwork | 0.183 |
Structure solution method | FOURIER SYNTHESIS |
Starting model (for MR) | 3TLN |
RMSD bond length | 0.020 |
RMSD bond angle | 3.530 |
Data reduction software | ROTAVATA |
Data scaling software | CCP4 ((AGROVATA) |
Phasing software | TNT |
Refinement software | TNT |
Data quality characteristics
Overall | |
Low resolution limit [Å] | 30.000 |
High resolution limit [Å] | 1.700 |
Rmerge | 0.098 |
Number of reflections | 26142 |
Completeness [%] | 68.0 |
Redundancy | 2.1 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | dilution with H2O | 7.2 | 277 | Tris acetate, calcium acetate, DMSO, pH 7.20, dilution with H2O, temperature 277K |