1BSJ
COBALT DEFORMYLASE INHIBITOR COMPLEX FROM E.COLI
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | ROTATING ANODE |
| Source details | RIGAKU |
| Temperature [K] | 283 |
| Detector technology | IMAGE PLATE |
| Collection date | 1998-05-15 |
| Detector | RIGAKU RAXIS |
| Spacegroup name | P 65 2 2 |
| Unit cell lengths | 99.080, 99.080, 111.040 |
| Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
| Resolution | 20.000 - 2.100 * |
| R-factor | 0.199 * |
| Rwork | 0.168 |
| R-free | 0.22800 * |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 1dff |
| RMSD bond length | 0.014 |
| RMSD bond angle | 1.594 |
| 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 | 3.100 |
| High resolution limit [Å] | 2.100 * | 2.100 * |
| Rmerge | 0.074 * | 0.236 * |
| Total number of observations | 118933 * | |
| Number of reflections | 16692 * | |
| Completeness [%] | 87.3 * | 87.7 * |
| Redundancy | 8.1 | 6.5 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | Vapor diffusion, hanging drop * | 7 * | 4 * | pH 7.5 |
Crystallization Reagents in Literatures
| ID | crystal ID | solution | reagent name | concentration (unit) | details |
| 1 | 1 | reservoir | Tris-HCl | 0.1 (M) | |
| 2 | 1 | reservoir | 1.9 (M) | ||
| 3 | 1 | drop | protein | 14.4 (mg/ml) | |
| 4 | 1 | drop | sodium phosphate | 20 (mM) | |
| 5 | 1 | drop | 10 (mM) | ||
| 6 | 1 | drop | ammonium sulfate | 0.86 (M) | |
| 7 | 1 | drop | inhibitor | 1 (mM) |
