5UZP
Crystal structure of citrate synthase mutant A348G from homo sapiens
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | APS BEAMLINE 22-BM |
Synchrotron site | APS |
Beamline | 22-BM |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2015-12-11 |
Detector | MARMOSAIC 300 mm CCD |
Wavelength(s) | 1 |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 58.245, 111.804, 74.162 |
Unit cell angles | 90.00, 99.31, 90.00 |
Refinement procedure
Resolution | 45.060 - 2.290 |
R-factor | 0.15824 |
Rwork | 0.156 |
R-free | 0.20549 |
Structure solution method | MOLECULAR REPLACEMENT |
RMSD bond length | 0.014 |
RMSD bond angle | 1.606 |
Data reduction software | HKL-2000 |
Data scaling software | HKL-2000 |
Phasing software | MOLREP |
Refinement software | REFMAC (5.8.0158) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 50.000 | 2.240 |
High resolution limit [Å] | 2.200 | 2.200 |
Rmerge | 0.129 | 0.768 |
Rmeas | 0.176 | 1.194 |
Rpim | 0.091 | 0.618 |
Number of reflections | 40046 | 2413 |
<I/σ(I)> | 10.8 | 1.75 |
Completeness [%] | 99.6 | 99.9 |
Redundancy | 3.7 | 3.7 |
CC(1/2) | 0.649 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 298 | 0.2 M Ammonium Acetate, 0.1 NaCitrate tribasic dihydrate pH 5.6, 15% PEG4000 |