1IL3
STRUCTURE OF RICIN A CHAIN BOUND WITH INHIBITOR 7-DEAZAGUANINE
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | ROTATING ANODE |
Source details | RIGAKU RU200 |
Temperature [K] | 298 |
Detector technology | IMAGE PLATE |
Collection date | 1999-08-24 |
Detector | RIGAKU RAXIS IV |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 42.770, 68.270, 49.930 |
Unit cell angles | 90.00, 112.90, 90.00 |
Refinement procedure
Resolution | 20.000 - 2.800 |
R-factor | 0.202 * |
Rwork | 0.202 |
R-free | 0.27300 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 1rtc |
RMSD bond length | 0.004 |
RMSD bond angle | 1.341 |
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] | 20.000 | 2.890 |
High resolution limit [Å] | 2.800 | 2.800 |
Rmerge | 0.071 * | 0.192 |
Total number of observations | 12592 * | |
Number of reflections | 6621 | |
<I/σ(I)> | 9.93 | |
Completeness [%] | 94.7 | 93.5 |
Redundancy | 1.9 | 1.67 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | Vapor diffusion, hanging drop * | 8.9 | 4 * | Mlsna, D., (1993) Protein Sci., 2, 429. * |
Crystallization Reagents in Literatures
ID | crystal ID | solution | reagent name | concentration (unit) | details |
1 | 1 | drop | protein | 2.2-2.4 (mg/ml) | |
2 | 1 | reservoir | Tris-HCl | 75 (mM) | pH8.9 |
3 | 1 | reservoir | beta-mercaptoethanol | 10 (mM) | |
4 | 1 | reservoir | EDTA | 1 (mM) | |
5 | 1 | reservoir | PEG8000 | 4.1 (%) |