1IDK
PECTIN LYASE A
Experimental procedure
Source type | SYNCHROTRON |
Source details | SRS BEAMLINE PX9.6 |
Synchrotron site | SRS |
Beamline | PX9.6 |
Temperature [K] | 290 |
Detector technology | IMAGE PLATE |
Collection date | 1994-06-09 |
Detector | MARRESEARCH |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 45.400, 83.500, 93.400 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 15.000 - 1.930 |
R-factor | 0.188 |
Rwork | 0.188 |
R-free | 0.23200 |
Structure solution method | MR + MIR |
Starting model (for MR) | DERIVED FROM BACILLUS SUBTILIS PECTATE LYASE |
RMSD bond length | 0.010 |
RMSD bond angle | 27.400 * |
Data reduction software | MOSFLM |
Data scaling software | CCP4 (V. 2.13 (AGROVATA) |
Phasing software | X-PLOR (3.1) |
Refinement software | X-PLOR (3.1) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 25.440 | 1.970 |
High resolution limit [Å] | 1.930 | 1.930 |
Rmerge | 0.061 | 0.250 |
Total number of observations | 80561 * | |
Number of reflections | 25695 | |
<I/σ(I)> | 19.47 | 5.3 |
Completeness [%] | 94.0 | 84.3 * |
Redundancy | 3.1 | 2.2 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | Vapor diffusion, hanging drop * | 8.5 | Jenkins, J., (1996) Acta Crystallogr.,Sect.D, 52, 402. * |
Crystallization Reagents in Literatures
ID | crystal ID | solution | reagent name | concentration (unit) | details |
1 | 1 | drop | protein | 20.4 (mg/ml) | |
2 | 1 | drop | PEG4000 | 9.3 (%) | |
3 | 1 | drop | sodium acetate | 33 (mM) | |
4 | 1 | reservoir | PEG4000 | 28 (%) | |
5 | 1 | reservoir | sodium acetate | 100 (mM) |