1BQJ
CRYSTAL STRUCTURE OF D(ACCCT)
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | ROTATING ANODE |
Source details | RIGAKU RU200 |
Temperature [K] | 103.15 |
Detector technology | IMAGE PLATE |
Collection date | 1997-11-01 |
Detector | RIGAKU RAXIS IIC |
Spacegroup name | I 2 3 |
Unit cell lengths | 93.810, 93.810, 93.810 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 15.000 - 2.200 |
R-factor | 0.192 |
Rwork | 0.192 |
R-free | 0.23500 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 191d |
RMSD bond length | 0.004 |
RMSD bond angle | 23.600 * |
Data reduction software | DENZO |
Data scaling software | SCALEPACK |
Phasing software | X-PLOR |
Refinement software | X-PLOR (3.851) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 15.000 | 2.300 |
High resolution limit [Å] | 2.200 | 2.200 |
Rmerge | 0.035 | |
Number of reflections | 7136 | |
Completeness [%] | 98.5 | 96.3 |
Redundancy | 4.5 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | Vapor diffusion, hanging drop * |
Crystallization Reagents in Literatures
ID | crystal ID | solution | reagent name | concentration (unit) | details |
1 | 1 | drop | protein | 5 (mM) | |
2 | 1 | drop | 2-propanol | 5 (%(v/v)) | |
3 | 1 | drop | ethanol | 10 (%(v/v)) | |
4 | 1 | drop | ammonium sulfate | 0.5 (M) | |
5 | 1 | drop | 150 (mM) | ||
6 | 1 | drop | 5 (mM) | ||
7 | 1 | drop | spermine | 2 (mM) |