7CQU
GmaS/ADP/MetSox-P complex
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SSRF BEAMLINE BL18U1 |
Synchrotron site | SSRF |
Beamline | BL18U1 |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2019-05-16 |
Detector | DECTRIS PILATUS3 6M |
Wavelength(s) | 0.979 |
Spacegroup name | I 2 2 2 |
Unit cell lengths | 116.598, 174.727, 190.618 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 36.896 - 2.060 |
R-factor | 0.165 |
Rwork | 0.163 |
R-free | 0.20150 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 7cql |
RMSD bond length | 0.007 |
RMSD bond angle | 1.125 |
Data reduction software | HKL-2000 |
Data scaling software | HKL-2000 |
Phasing software | PHASER |
Refinement software | PHENIX (1.6.4_486) |
Data quality characteristics
Overall | Inner shell | Outer shell | |
Low resolution limit [Å] | 50.000 | 50.000 | 2.180 |
High resolution limit [Å] | 2.060 | 4.520 | 2.100 |
Rmerge | 0.090 | 0.043 | 0.460 |
Rmeas | 0.102 | 0.048 | 0.546 |
Rpim | 0.048 | 0.019 | 0.286 |
Number of reflections | 114519 | 12133 | 11040 |
<I/σ(I)> | 13.1 | ||
Completeness [%] | 97.5 | 100 | 94.5 |
Redundancy | 4 | 6 | 3 |
CC(1/2) | 0.996 | 0.811 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 8.5 | 291 | 0.1 M bicine (pH 8.5), 10% (v/v) 2-propanol, 30% (v/v) polyethylene glycol 1500 |