5BJZ
Crystal structure of maltose binding protein in complex with an allosteric synthetic antibody
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | APS BEAMLINE 24-ID-C |
Synchrotron site | APS |
Beamline | 24-ID-C |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2014-10-10 |
Detector | DECTRIS PILATUS3 S 6M |
Wavelength(s) | 0.980 |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 98.390, 87.590, 114.650 |
Unit cell angles | 90.00, 114.29, 90.00 |
Refinement procedure
Resolution | 19.957 - 1.950 |
R-factor | 0.1959 |
Rwork | 0.194 |
R-free | 0.22910 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 3pgf |
RMSD bond length | 0.006 |
RMSD bond angle | 0.769 |
Data scaling software | XSCALE |
Phasing software | PHASER |
Refinement software | PHENIX |
Data quality characteristics
Overall | Inner shell | Outer shell | |
Low resolution limit [Å] | 19.957 | 19.957 | 2.000 |
High resolution limit [Å] | 1.950 | 10.000 | 1.950 |
Rmerge | 0.076 | 0.033 | 0.896 |
Rmeas | 0.091 | 0.039 | 1.066 |
Number of reflections | 126257 | 1011 | 9254 |
<I/σ(I)> | 9.85 | 34.07 | 1.75 |
Completeness [%] | 97.5 | 98.2 | 98.2 |
Redundancy | 3.316 | 3.575 | 3.414 |
CC(1/2) | 0.997 | 0.996 | 0.642 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 7 | 283 | 0.1 M HEPES: pH 7.0 and 15% PEG4000 |