1M7J
Crystal structure of D-aminoacylase defines a novel subset of amidohydrolases
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SPRING-8 BEAMLINE BL41XU |
Synchrotron site | SPring-8 |
Beamline | BL41XU |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2002-04-10 |
Detector | ADSC QUANTUM 4 |
Wavelength(s) | 1.0 |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 60.102, 77.167, 135.744 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 150.000 * - 1.500 |
R-factor | 0.161 |
Rwork | 0.160 |
R-free | 0.17400 |
Structure solution method | SAD |
RMSD bond length | 0.015 |
RMSD bond angle | 1.770 |
Data reduction software | HKL-2000 |
Data scaling software | SCALEPACK |
Phasing software | CNS |
Refinement software | CNS |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 150.000 * | 1.550 |
High resolution limit [Å] | 1.500 | 1.500 |
Rmerge | 0.047 | 0.116 |
Number of reflections | 100783 | 9984 * |
<I/σ(I)> | 50.5 | 17.6 |
Completeness [%] | 99.2 | 100 |
Redundancy | 6.3 | 6.6 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 5.6 | 295 | Hsu, C.-S., (2002) Acta Crystallogr., Sect.D, 58, 1482. * |
1 | VAPOR DIFFUSION, HANGING DROP | 5.6 | 295 | Hsu, C.-S., (2002) Acta Crystallogr., Sect.D, 58, 1482. * |
Crystallization Reagents in Literatures
ID | crystal ID | solution | reagent name | concentration (unit) | details |
1 | 1 | reservoir | PEG4000 | 25-30 (%) | |
2 | 1 | reservoir | sodium citrate | 0.1 (M) | pH5.6 |
3 | 1 | reservoir | ammonium acetate | 0.2 (M) | |
4 | 1 | drop | protein | 12-20 (mg/ml) |