1A0Q
29G11 COMPLEXED WITH PHENYL [1-(1-N-SUCCINYLAMINO)PENTYL] PHOSPHONATE
Experimental procedure
Source type | ROTATING ANODE |
Source details | RIGAKU RUH3R |
Temperature [K] | 93 |
Detector technology | IMAGE PLATE |
Collection date | 1997-02 |
Detector | RIGAKU |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 36.780, 82.610, 132.340 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 50.000 - 2.300 |
R-factor | 0.203 |
Rwork | 0.203 |
R-free | 0.27500 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | PDP ENTRY 1EAP |
RMSD bond length | 0.009 |
RMSD bond angle | 26.600 * |
Data reduction software | DENZO |
Data scaling software | SCALEPACK |
Phasing software | X-PLOR (3.843) |
Refinement software | X-PLOR (3.843) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 50.000 | 2.400 |
High resolution limit [Å] | 2.300 | 2.300 |
Rmerge | 0.080 | 0.280 |
Total number of observations | 85418 * | |
Number of reflections | 20072 | |
<I/σ(I)> | 8.7 | 3.2 |
Completeness [%] | 94.9 | 90.2 |
Redundancy | 4 | 3.1 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | Vapor diffusion, hanging drop * | 6 | pH 6.0 |
Crystallization Reagents in Literatures
ID | crystal ID | solution | reagent name | concentration (unit) | details |
1 | 1 | drop | protein | 10 (mg/ml) | |
2 | 1 | reservoir | PEG8000 | 11 (%) | |
3 | 1 | reservoir | zinc acetate | 0.2 (M) | |
4 | 1 | reservoir | cacodylate | 0.1 (M) | pH6 |