7AVM
Crystal Structure of Pro-Rhodesain C150A
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | ROTATING ANODE |
Source details | BRUKER AXS MICROSTAR-H |
Temperature [K] | 100 |
Detector technology | IMAGE PLATE |
Collection date | 2018-07-11 |
Detector | MAR scanner 300 mm plate |
Wavelength(s) | 1.5417 |
Spacegroup name | H 3 |
Unit cell lengths | 123.190, 123.190, 53.910 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 37.920 - 2.800 |
R-factor | 0.2556 |
Rwork | 0.254 |
R-free | 0.26180 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 6ex8 |
RMSD bond length | 0.010 |
RMSD bond angle | 1.599 |
Data reduction software | XDS |
Data scaling software | XDS |
Phasing software | PHENIX (1.16_3549) |
Refinement software | PHENIX (1.18.2_3874) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 37.920 | 2.900 |
High resolution limit [Å] | 2.800 | 2.800 |
Number of reflections | 7512 | 729 |
<I/σ(I)> | 214.7 | |
Completeness [%] | 97.2 | 92.73 |
Redundancy | 20.6 | |
CC(1/2) | 0.919 | 0.905 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 3.5 | 300 | 40 mM sodium citrate, 30% PEG-6000, Lead(II) acetate (saturated),cryoprotection with glycerol 10% |