4YN3
Crystal structure of Cucumisin complex with pro-peptide
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SPRING-8 BEAMLINE BL32XU |
Synchrotron site | SPring-8 |
Beamline | BL32XU |
Temperature [K] | 110 |
Detector technology | CCD |
Collection date | 2013-10-30 |
Detector | MARRESEARCH |
Wavelength(s) | 1.0 |
Spacegroup name | P 42 |
Unit cell lengths | 97.738, 97.738, 73.433 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 34.560 - 1.950 |
R-factor | 0.184 |
Rwork | 0.184 |
R-free | 0.22200 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 3vta |
RMSD bond length | 0.005 |
RMSD bond angle | 1.300 |
Data reduction software | HKL-2000 |
Data scaling software | HKL-2000 |
Phasing software | MOLREP |
Refinement software | CNS (1.1) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 50.000 | 2.020 |
High resolution limit [Å] | 1.950 | 1.950 |
Number of reflections | 49147 | |
<I/σ(I)> | 19.5 | 3.7 |
Completeness [%] | 98.5 | 97.8 |
Redundancy | 7.3 | 7.1 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 293 | Ammonium Sulfate, Pentaerythritol Ethoxylate |