1MDL
MANDELATE RACEMASE MUTANT K166R CO-CRYSTALLIZED WITH (R)-MANDELATE
Experimental procedure
Detector technology | AREA DETECTOR |
Collection date | 1992-11-12 |
Detector | SIEMENS |
Spacegroup name | I 4 2 2 |
Unit cell lengths | 125.320, 125.320, 106.420 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 20.000 - 1.850 |
R-factor | 0.184 * |
Rwork | 0.184 |
RMSD bond length | 0.019 |
RMSD bond angle | 24.000 * |
Data reduction software | XDS |
Data scaling software | XSCALE |
Refinement software | TNT |
Data quality characteristics
Overall | |
High resolution limit [Å] | 1.850 * |
Rmerge | 0.110 |
Number of reflections | 33438 |
Completeness [%] | 90.5 |
Redundancy | 3.5 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | Vapor diffusion, hanging drop * | 7.5 * | Mitra, B., (1995) Biochemistry, 34, 2777. * |
Crystallization Reagents in Literatures
ID | crystal ID | solution | reagent name | concentration (unit) | details |
1 | 1 | drop | Tris | 50 (mM) | |
2 | 1 | drop | 10 (mM) | ||
3 | 1 | drop | (S)-atrolactate | 50 (mM) | |
4 | 1 | drop | atrolactate | 5 (mM) | |
5 | 1 | reservoir | 30 (%) | ||
6 | 1 | reservoir | acetone | 3 (%(v/v)) |