1MKA
E. COLI BETA-HYDROXYDECANOYL THIOL ESTER DEHYDRASE MODIFIED BY ITS CLASSIC MECHANISM-BASED INACTIVATOR, 3-DECYNOYL-N-ACETYL CYSTEAMINE
Experimental procedure
Detector technology | AREA DETECTOR |
Collection date | 1992-03 |
Detector | SIEMENS |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 68.000, 86.800, 60.300 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 7.000 - 2.000 |
R-factor | 0.163 |
Rwork | 0.163 |
R-free | 0.21400 |
RMSD bond length | 0.010 |
RMSD bond angle | 27.700 * |
Data reduction software | XDS |
Phasing software | X-PLOR |
Refinement software | X-PLOR |
Data quality characteristics
Overall | |
High resolution limit [Å] | 2.000 * |
Rmerge | 0.048 |
Number of reflections | 26075 * |
Completeness [%] | 97.0 * |
Redundancy | 3.3 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | unknown * |
Crystallization Reagents in Literatures
ID | crystal ID | solution | reagent name | concentration (unit) | details |
1 | 1 | 1 | protein | 2.5 (mg/ml) | |
2 | 1 | 1 | 3-decynoylNAC | 3.7 (mM) | |
3 | 1 | 1 | aceton | 2 (%(v/v)) |