5HL1
Crystal structure of glutaminase C in complex with inhibitor CB-839
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | CHESS BEAMLINE A1 |
Synchrotron site | CHESS |
Beamline | A1 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2015-05-28 |
Detector | ADSC QUANTUM 210 |
Wavelength(s) | 0.63 |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 98.530, 139.382, 177.959 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 47.479 - 2.400 |
R-factor | 0.2257 |
Rwork | 0.225 |
R-free | 0.26360 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 5d3o |
RMSD bond length | 0.010 |
RMSD bond angle | 1.121 |
Data reduction software | HKL-2000 |
Data scaling software | HKL-2000 |
Phasing software | PHASER |
Refinement software | PHENIX ((1.10.1_2155: ???)) |
Data quality characteristics
Overall | |
Low resolution limit [Å] | 50.000 |
High resolution limit [Å] | 2.400 |
Number of reflections | 96364 |
<I/σ(I)> | 15.6 |
Completeness [%] | 99.9 |
Redundancy | 7.3 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 8 | 293 | 10% PEG6000 |