7JWF
Crystal structure of PdGH110B D344N in complex with alpha-(1,3)-galactobiose
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | ROTATING ANODE |
Source details | RIGAKU MICROMAX-002 |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2016-12-02 |
Detector | DECTRIS PILATUS 200K |
Wavelength(s) | 1.514 |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 98.517, 124.763, 142.423 |
Unit cell angles | 90.00, 93.86, 90.00 |
Refinement procedure
Resolution | 29.759 - 2.187 |
R-factor | 0.2065 |
Rwork | 0.205 |
R-free | 0.23710 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 7jw4 |
Data reduction software | HKL-2000 |
Data scaling software | HKL-2000 |
Phasing software | REFMAC |
Refinement software | PHENIX (1.15.2_3472) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 30.000 | 2.240 |
High resolution limit [Å] | 2.187 | 2.200 |
Number of reflections | 174470 | 7427 |
<I/σ(I)> | 7.1 | |
Completeness [%] | 98.6 | |
Redundancy | 3.6 | |
CC(1/2) | 0.991 | 0.833 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 7.5 | 291 | PEG 3350, HEPES, NaI, Tacsimate |