1BSK
ZINC 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 | 99.170, 99.170, 110.755 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 20.000 - 2.400 * |
R-factor | 0.199 * |
Rwork | 0.167 |
R-free | 0.22300 * |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 1dff |
RMSD bond length | 0.015 |
RMSD bond angle | 1.739 |
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] | 2.400 * | 2.400 * |
Rmerge | 0.079 * | 0.240 * |
Total number of observations | 58431 * | |
Number of reflections | 10960 * | |
Completeness [%] | 85.2 * | 86.3 * |
Redundancy | 3.2 |
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) |